The data consists of Raman spectra of macrophages. Data treatment is mainly based on the library specio.
from specio import specread # pip install git+https://github.com/paris-saclay-cds/specio.git
from os import path
import glob
from SPARQLWrapper import SPARQLWrapper, JSON
import urllib.request
import os
import errno
import numpy as np
sparql = SPARQLWrapper("https://opendata1.opendata.u-psud.fr/sparql/")
sparql.setQuery("""
prefix daapp: <http://daap.dsi.universite-paris-saclay.fr/wiki/Data:Project#>
prefix project:<http://daap.dsi.universite-paris-saclay.fr/wiki/Data:Analyse_des_macrophages#>
prefix rdfs: <http://www.w3.org/2000/01/rdf-schema#>
select ?spc
where {
<http://daap.dsi.universite-paris-saclay.fr/wiki/Analyse_des_macrophages_méthode_1> daapp:hasCampaign ?campaign .
?campaign project:hasSlide ?slide .
?slide project:hasCell ?cell .
?cell project:hasPosition ?position.
?position project:hasMeasure ?spc .
}
""")
sparql.setReturnFormat(JSON)
results = sparql.query().convert()
path = "/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02"
if not os.path.exists(path):
os.makedirs(path, exist_ok=False)
filenames = []
for result in results["results"]["bindings"]:
filename = result["spc"]["value"].replace("http://134.158.74.40/", "/home/jupyter/Notebooks/htdocs/")
if not os.path.exists(filename):
print('Beginning data file:'+filename)
urllib.request.urlretrieve(result["spc"]["value"],filename)
filenames.append(filename)
filenames
['/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell05_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell05_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell02_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell03_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EPA_L02_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EPA_L02_cell07_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell05_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell06_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell01_c3.spc', 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'/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell01_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell02_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell07_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EPA_L02_cell01_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EPA_L02_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EPA_L02_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell02_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell02_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell04_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell04_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell04_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell04_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell03_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell07_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell02_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell03_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell06_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_c1.spc']
# DATA_PATH = ("/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02")
# EXT_FILE = "*.spc"
# filenames = glob.glob(path.join(DATA_PATH, EXT_FILE))
# filenames
filenames
['/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell01_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell05_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell05_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell04_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell03_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L02_cell03_c3.spc', 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'/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell07_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412LDL_L02_cell07_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell02_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell05_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EDL_L03_cell05_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell03_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170412EDL_L02_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413STD_L03_cell07_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell02_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell06_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell02_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell01_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410LDL_L01_cell03_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170410EDL_L01_cell04_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell02_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell06_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413EPA_L03_cell06_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411EPA_L01_cell03_c3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_n2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_c1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170411STD_L01_cell06_c2.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_n1.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_n3.spc', '/home/jupyter/Notebooks/htdocs/Macrophages_imagerie/Methode_01/Campagne_02/20170413LDL_L03_cell07_c1.spc']
# def convert(f):
# #print(f)
# specread(f)
list_raman = [specread(f)
for f in filenames]
x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1)
print(type(list_raman[0]))
<class 'specio.core.util.Spectrum'>
cell_medium = ["EDL", "LDL", "STD", "EPA"]
dict_raman = {k: [] for k in cell_medium}
for key in dict_raman.keys():
for f in filenames:
if key in f:
dict_raman[key].append(specread(f))
x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1) x-y(1)
spectrum = np.array([sp.amplitudes for sp in list_raman])
print(spectrum.shape)
(504, 1732)
metadata = []
for f in filenames:
name = os.path.basename(f)
date, plate, cell, comp = name.split('_')
date, medium = date[:8], date[8:]
comp = comp.split('.')[0]
metadata.append({'filename': name,
'date': date,
'medium': medium,
'plate': plate,
'cell': cell,
'comp': comp[0]})
import pandas as pd
metadata = pd.DataFrame(metadata)
print(metadata.head())
cell comp date filename medium plate 0 cell01 n 20170410 20170410LDL_L01_cell01_n1.spc LDL L01 1 cell01 n 20170410 20170410LDL_L01_cell01_n2.spc LDL L01 2 cell01 c 20170410 20170410LDL_L01_cell01_c1.spc LDL L01 3 cell07 n 20170413 20170413EPA_L03_cell07_n2.spc EPA L03 4 cell07 n 20170413 20170413EPA_L03_cell07_n3.spc EPA L03
df_spectrum = pd.DataFrame(spectrum, columns=list_raman[0].wavelength)
df_spectrum = pd.concat([metadata[['filename', 'medium', 'plate', 'comp']],
df_spectrum], axis='columns')
from openpyxl import Workbook
df_spectrum.to_excel("/home/jupyter/Notebooks/htdocs/data_RAMAN.xlsx")
df = df_spectrum.set_index(['filename', 'medium', 'plate', 'comp'])
print(df.head)
<bound method NDFrame.head of 400.199219 402.729828 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 270.222229 279.777771 20170410LDL_L01_cell01_n2.spc LDL L01 n 296.555542 284.000000 20170410LDL_L01_cell01_c1.spc LDL L01 c 200.000000 212.222214 20170413EPA_L03_cell07_n2.spc EPA L03 n 267.222260 273.888885 20170413EPA_L03_cell07_n3.spc EPA L03 n 254.333359 257.888855 20170413EPA_L03_cell07_c1.spc EPA L03 c 176.000015 197.555557 20170413LDL_L03_cell05_c1.spc LDL L03 c 179.333328 190.666672 20170413LDL_L03_cell05_c3.spc LDL L03 c 170.222214 175.555557 20170412EDL_L02_cell04_n1.spc EDL L02 n 210.111115 216.555557 20170412EDL_L02_cell04_c1.spc EDL L02 c 175.000015 179.111115 20170412EDL_L02_cell04_c2.spc EDL L02 c 175.000015 179.111115 20170413EDL_L03_cell07_n1.spc EDL L03 n 322.777771 320.777771 20170413EDL_L03_cell07_n2.spc EDL L03 n 224.444443 233.000000 20170413EDL_L03_cell07_c1.spc EDL L03 c 193.555557 192.111115 20170413LDL_L03_cell06_n3.spc LDL L03 n 191.444443 197.111115 20170413LDL_L03_cell06_c1.spc LDL L03 c 152.555573 170.444427 20170413LDL_L03_cell06_c2.spc LDL L03 c 160.888885 169.333328 20170412EDL_L02_cell05_n2.spc EDL L02 n 192.555573 201.222229 20170413LDL_L03_cell06_c3.spc LDL L03 c 191.333328 200.555557 20170411STD_L02_cell07_n1.spc STD L02 n 219.555557 226.111115 20170411STD_L01_cell04_n2.spc STD L01 n 217.777771 227.444443 20170411STD_L01_cell04_n3.spc STD L01 n 180.666672 187.777771 20170411STD_L01_cell04_c3.spc STD L01 c 156.888885 166.666672 20170411STD_L02_cell03_n2.spc STD L02 n 218.333328 225.777771 20170413STD_L03_cell01_n1.spc STD L03 n 232.555557 230.777771 20170413STD_L03_cell01_n2.spc STD L03 n 259.999969 267.555542 20170411STD_L02_cell03_c3.spc STD L02 c 191.888885 198.555557 20170413STD_L03_cell01_c3.spc STD L03 c 181.777771 193.777771 20170413LDL_L03_cell01_c3.spc LDL L03 c 174.666687 183.333328 20170411STD_L02_cell05_n1.spc STD L02 n 245.555557 255.111130 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 285.222229 298.555542 20170411EPA_L01_cell07_n3.spc EPA L01 n 228.000015 237.555573 20170413STD_L03_cell07_c1.spc STD L03 c 174.888885 179.333328 20170413LDL_L03_cell02_c2.spc LDL L03 c 181.555573 194.333344 20170413LDL_L03_cell02_c3.spc LDL L03 c 186.555557 198.555573 20170410LDL_L01_cell06_c3.spc LDL L01 c 159.555557 166.222229 20170410LDL_L01_cell02_n1.spc LDL L01 n 304.888855 305.333344 20170410LDL_L01_cell02_c1.spc LDL L01 c 332.333344 332.888885 20170413EPA_L03_cell01_n1.spc EPA L03 n 244.555557 261.000000 20170413EPA_L03_cell01_n2.spc EPA L03 n 219.111130 222.222229 20170413EPA_L03_cell01_c1.spc EPA L03 c 174.777771 182.555557 20170413EPA_L03_cell01_c2.spc EPA L03 c 165.000000 173.111115 20170413EPA_L03_cell01_c3.spc EPA L03 c 160.888885 173.333328 20170410LDL_L01_cell03_n3.spc LDL L01 n 218.333328 230.222229 20170410EDL_L01_cell04_n1.spc EDL L01 n 181.000000 210.111115 20170410EDL_L01_cell04_n3.spc EDL L01 n 187.666672 204.777771 20170410EDL_L01_cell04_c1.spc EDL L01 c 163.999985 180.999985 20170410EDL_L01_cell04_c2.spc EDL L01 c 189.111115 197.555573 20170413EPA_L03_cell02_n1.spc EPA L03 n 192.444443 194.222229 20170413EPA_L03_cell06_n2.spc EPA L03 n 216.666672 226.444443 20170413EPA_L03_cell06_n3.spc EPA L03 n 200.444443 201.444443 20170411EPA_L01_cell03_c1.spc EPA L01 c 175.999985 178.666672 20170411EPA_L01_cell03_c2.spc EPA L01 c 200.000000 208.666672 20170411EPA_L01_cell03_c3.spc EPA L01 c 166.222229 174.777771 20170411STD_L01_cell06_n2.spc STD L01 n 211.888885 217.222229 20170411STD_L01_cell06_c1.spc STD L01 c 162.444443 168.444443 20170411STD_L01_cell06_c2.spc STD L01 c 161.222229 168.666672 20170413LDL_L03_cell07_n1.spc LDL L03 n 227.333328 235.222229 20170413LDL_L03_cell07_n3.spc LDL L03 n 219.555557 235.333313 20170413LDL_L03_cell07_c1.spc LDL L03 c 194.888885 212.222229 405.259583 407.788513 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 276.444458 287.111115 20170410LDL_L01_cell01_n2.spc LDL L01 n 282.111115 284.111115 20170410LDL_L01_cell01_c1.spc LDL L01 c 215.555557 213.444458 20170413EPA_L03_cell07_n2.spc EPA L03 n 286.333344 278.777771 20170413EPA_L03_cell07_n3.spc EPA L03 n 273.444427 262.888885 20170413EPA_L03_cell07_c1.spc EPA L03 c 195.666687 194.555557 20170413LDL_L03_cell05_c1.spc LDL L03 c 191.888885 187.444443 20170413LDL_L03_cell05_c3.spc LDL L03 c 182.333328 169.555542 20170412EDL_L02_cell04_n1.spc EDL L02 n 222.000000 224.999985 20170412EDL_L02_cell04_c1.spc EDL L02 c 178.666672 171.777771 20170412EDL_L02_cell04_c2.spc EDL L02 c 178.666672 171.777771 20170413EDL_L03_cell07_n1.spc EDL L03 n 341.777771 342.777771 20170413EDL_L03_cell07_n2.spc EDL L03 n 231.666672 238.888885 20170413EDL_L03_cell07_c1.spc EDL L03 c 199.666672 197.555557 20170413LDL_L03_cell06_n3.spc LDL L03 n 206.222229 200.333328 20170413LDL_L03_cell06_c1.spc LDL L03 c 166.000000 167.111115 20170413LDL_L03_cell06_c2.spc LDL L03 c 168.777771 165.888870 20170412EDL_L02_cell05_n2.spc EDL L02 n 205.555557 206.222214 20170413LDL_L03_cell06_c3.spc LDL L03 c 204.444427 196.888885 20170411STD_L02_cell07_n1.spc STD L02 n 230.666672 221.555557 20170411STD_L01_cell04_n2.spc STD L01 n 233.000000 226.888885 20170411STD_L01_cell04_n3.spc STD L01 n 181.888885 182.555557 20170411STD_L01_cell04_c3.spc STD L01 c 165.666672 162.555573 20170411STD_L02_cell03_n2.spc STD L02 n 224.222229 229.888885 20170413STD_L03_cell01_n1.spc STD L03 n 231.444443 236.333328 20170413STD_L03_cell01_n2.spc STD L03 n 272.666656 272.777771 20170411STD_L02_cell03_c3.spc STD L02 c 190.222229 196.222229 20170413STD_L03_cell01_c3.spc STD L03 c 193.111115 186.111130 20170413LDL_L03_cell01_c3.spc LDL L03 c 176.888885 182.444443 20170411STD_L02_cell05_n1.spc STD L02 n 250.444443 251.333328 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 298.777771 290.444458 20170411EPA_L01_cell07_n3.spc EPA L01 n 234.777786 238.000000 20170413STD_L03_cell07_c1.spc STD L03 c 187.666672 193.555557 20170413LDL_L03_cell02_c2.spc LDL L03 c 193.333328 186.333328 20170413LDL_L03_cell02_c3.spc LDL L03 c 195.222229 196.000015 20170410LDL_L01_cell06_c3.spc LDL L01 c 161.444443 163.000000 20170410LDL_L01_cell02_n1.spc LDL L01 n 305.222229 292.777771 20170410LDL_L01_cell02_c1.spc LDL L01 c 334.666656 338.888885 20170413EPA_L03_cell01_n1.spc EPA L03 n 259.555542 257.888885 20170413EPA_L03_cell01_n2.spc EPA L03 n 223.333328 220.111115 20170413EPA_L03_cell01_c1.spc EPA L03 c 181.222214 181.777771 20170413EPA_L03_cell01_c2.spc EPA L03 c 168.777771 171.888870 20170413EPA_L03_cell01_c3.spc EPA L03 c 170.555573 177.777771 20170410LDL_L01_cell03_n3.spc LDL L01 n 226.000000 219.111115 20170410EDL_L01_cell04_n1.spc EDL L01 n 202.333328 199.333328 20170410EDL_L01_cell04_n3.spc EDL L01 n 209.888885 208.000015 20170410EDL_L01_cell04_c1.spc EDL L01 c 177.444443 180.555557 20170410EDL_L01_cell04_c2.spc EDL L01 c 198.888885 200.888885 20170413EPA_L03_cell02_n1.spc EPA L03 n 201.333328 203.777771 20170413EPA_L03_cell06_n2.spc EPA L03 n 221.111115 220.555557 20170413EPA_L03_cell06_n3.spc EPA L03 n 198.111115 208.777771 20170411EPA_L01_cell03_c1.spc EPA L01 c 187.444443 174.111115 20170411EPA_L01_cell03_c2.spc EPA L01 c 209.777771 196.333328 20170411EPA_L01_cell03_c3.spc EPA L01 c 174.000000 180.999985 20170411STD_L01_cell06_n2.spc STD L01 n 230.000000 224.000000 20170411STD_L01_cell06_c1.spc STD L01 c 168.888885 165.888870 20170411STD_L01_cell06_c2.spc STD L01 c 162.111115 165.888885 20170413LDL_L03_cell07_n1.spc LDL L03 n 241.777771 236.222229 20170413LDL_L03_cell07_n3.spc LDL L03 n 232.222214 234.888885 20170413LDL_L03_cell07_c1.spc LDL L03 c 206.222229 202.000000 410.316620 412.843903 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 287.666656 283.111115 20170410LDL_L01_cell01_n2.spc LDL L01 n 294.000000 312.555542 20170410LDL_L01_cell01_c1.spc LDL L01 c 208.333328 215.555557 20170413EPA_L03_cell07_n2.spc EPA L03 n 281.222229 269.222229 20170413EPA_L03_cell07_n3.spc EPA L03 n 266.666656 269.666656 20170413EPA_L03_cell07_c1.spc EPA L03 c 192.666656 186.777771 20170413LDL_L03_cell05_c1.spc LDL L03 c 189.444427 188.222229 20170413LDL_L03_cell05_c3.spc LDL L03 c 183.666672 172.888885 20170412EDL_L02_cell04_n1.spc EDL L02 n 217.777771 214.333328 20170412EDL_L02_cell04_c1.spc EDL L02 c 182.333328 177.888885 20170412EDL_L02_cell04_c2.spc EDL L02 c 182.333328 177.888885 20170413EDL_L03_cell07_n1.spc EDL L03 n 329.777771 335.222229 20170413EDL_L03_cell07_n2.spc EDL L03 n 241.000000 241.000000 20170413EDL_L03_cell07_c1.spc EDL L03 c 194.444443 199.444443 20170413LDL_L03_cell06_n3.spc LDL L03 n 197.111115 191.666672 20170413LDL_L03_cell06_c1.spc LDL L03 c 165.333328 166.777771 20170413LDL_L03_cell06_c2.spc LDL L03 c 166.111115 171.777771 20170412EDL_L02_cell05_n2.spc EDL L02 n 199.666672 203.333328 20170413LDL_L03_cell06_c3.spc LDL L03 c 201.222229 199.666687 20170411STD_L02_cell07_n1.spc STD L02 n 217.888885 228.666672 20170411STD_L01_cell04_n2.spc STD L01 n 225.444443 229.666672 20170411STD_L01_cell04_n3.spc STD L01 n 191.111115 178.333328 20170411STD_L01_cell04_c3.spc STD L01 c 162.000000 161.222229 20170411STD_L02_cell03_n2.spc STD L02 n 235.777771 230.000000 20170413STD_L03_cell01_n1.spc STD L03 n 239.333313 234.333328 20170413STD_L03_cell01_n2.spc STD L03 n 273.777771 267.888885 20170411STD_L02_cell03_c3.spc STD L02 c 205.000000 196.555557 20170413STD_L03_cell01_c3.spc STD L03 c 192.777771 194.666672 20170413LDL_L03_cell01_c3.spc LDL L03 c 182.777771 181.777771 20170411STD_L02_cell05_n1.spc STD L02 n 256.222229 251.333328 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 301.666656 292.555542 20170411EPA_L01_cell07_n3.spc EPA L01 n 232.666672 233.444443 20170413STD_L03_cell07_c1.spc STD L03 c 185.222229 189.888885 20170413LDL_L03_cell02_c2.spc LDL L03 c 191.222229 195.777771 20170413LDL_L03_cell02_c3.spc LDL L03 c 197.555557 199.666672 20170410LDL_L01_cell06_c3.spc LDL L01 c 166.555557 161.000000 20170410LDL_L01_cell02_n1.spc LDL L01 n 304.000000 305.777771 20170410LDL_L01_cell02_c1.spc LDL L01 c 342.222229 342.222229 20170413EPA_L03_cell01_n1.spc EPA L03 n 262.777771 259.444458 20170413EPA_L03_cell01_n2.spc EPA L03 n 228.777771 218.000000 20170413EPA_L03_cell01_c1.spc EPA L03 c 182.777771 179.666672 20170413EPA_L03_cell01_c2.spc EPA L03 c 173.777771 169.000000 20170413EPA_L03_cell01_c3.spc EPA L03 c 172.444443 160.888885 20170410LDL_L01_cell03_n3.spc LDL L01 n 225.222229 227.666672 20170410EDL_L01_cell04_n1.spc EDL L01 n 194.888885 192.555557 20170410EDL_L01_cell04_n3.spc EDL L01 n 203.888901 201.888885 20170410EDL_L01_cell04_c1.spc EDL L01 c 186.777771 185.000000 20170410EDL_L01_cell04_c2.spc EDL L01 c 192.222229 203.555557 20170413EPA_L03_cell02_n1.spc EPA L03 n 205.777771 204.111115 20170413EPA_L03_cell06_n2.spc EPA L03 n 231.111099 223.111115 20170413EPA_L03_cell06_n3.spc EPA L03 n 204.000015 197.333328 20170411EPA_L01_cell03_c1.spc EPA L01 c 186.444427 182.333344 20170411EPA_L01_cell03_c2.spc EPA L01 c 207.555557 202.888885 20170411EPA_L01_cell03_c3.spc EPA L01 c 173.000000 179.000000 20170411STD_L01_cell06_n2.spc STD L01 n 225.000000 218.555557 20170411STD_L01_cell06_c1.spc STD L01 c 166.555557 172.555557 20170411STD_L01_cell06_c2.spc STD L01 c 165.666672 172.222229 20170413LDL_L03_cell07_n1.spc LDL L03 n 227.444443 233.444443 20170413LDL_L03_cell07_n3.spc LDL L03 n 231.888885 232.444427 20170413LDL_L03_cell07_c1.spc LDL L03 c 195.666687 204.777771 415.370331 417.895966 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 274.000000 282.777771 20170410LDL_L01_cell01_n2.spc LDL L01 n 348.555542 388.111115 20170410LDL_L01_cell01_c1.spc LDL L01 c 215.888885 215.888885 20170413EPA_L03_cell07_n2.spc EPA L03 n 271.555542 283.777771 20170413EPA_L03_cell07_n3.spc EPA L03 n 266.888885 263.666656 20170413EPA_L03_cell07_c1.spc EPA L03 c 195.222229 181.777771 20170413LDL_L03_cell05_c1.spc LDL L03 c 190.000000 185.555542 20170413LDL_L03_cell05_c3.spc LDL L03 c 182.666687 181.555557 20170412EDL_L02_cell04_n1.spc EDL L02 n 219.555573 211.888885 20170412EDL_L02_cell04_c1.spc EDL L02 c 180.888901 180.888901 20170412EDL_L02_cell04_c2.spc EDL L02 c 180.888901 180.888901 20170413EDL_L03_cell07_n1.spc EDL L03 n 325.111115 328.444458 20170413EDL_L03_cell07_n2.spc EDL L03 n 233.000000 246.333313 20170413EDL_L03_cell07_c1.spc EDL L03 c 199.777771 195.777771 20170413LDL_L03_cell06_n3.spc LDL L03 n 196.000000 196.555573 20170413LDL_L03_cell06_c1.spc LDL L03 c 166.000000 169.333328 20170413LDL_L03_cell06_c2.spc LDL L03 c 164.000015 167.333328 20170412EDL_L02_cell05_n2.spc EDL L02 n 206.000000 201.333328 20170413LDL_L03_cell06_c3.spc LDL L03 c 202.444443 200.888885 20170411STD_L02_cell07_n1.spc STD L02 n 222.666687 225.111115 20170411STD_L01_cell04_n2.spc STD L01 n 219.777771 222.111115 20170411STD_L01_cell04_n3.spc STD L01 n 183.333328 178.555557 20170411STD_L01_cell04_c3.spc STD L01 c 161.111115 161.777771 20170411STD_L02_cell03_n2.spc STD L02 n 229.555557 225.666672 20170413STD_L03_cell01_n1.spc STD L03 n 228.111130 237.000000 20170413STD_L03_cell01_n2.spc STD L03 n 270.111115 259.111084 20170411STD_L02_cell03_c3.spc STD L02 c 197.222214 193.222229 20170413STD_L03_cell01_c3.spc STD L03 c 191.222229 190.666672 20170413LDL_L03_cell01_c3.spc LDL L03 c 176.888885 191.222214 20170411STD_L02_cell05_n1.spc STD L02 n 255.777771 252.222229 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 288.555542 296.888885 20170411EPA_L01_cell07_n3.spc EPA L01 n 229.555557 230.111130 20170413STD_L03_cell07_c1.spc STD L03 c 187.222229 185.555557 20170413LDL_L03_cell02_c2.spc LDL L03 c 191.444443 191.666672 20170413LDL_L03_cell02_c3.spc LDL L03 c 201.222229 195.444443 20170410LDL_L01_cell06_c3.spc LDL L01 c 164.555557 168.111115 20170410LDL_L01_cell02_n1.spc LDL L01 n 314.000000 316.888855 20170410LDL_L01_cell02_c1.spc LDL L01 c 341.888916 348.666656 20170413EPA_L03_cell01_n1.spc EPA L03 n 263.444458 252.888885 20170413EPA_L03_cell01_n2.spc EPA L03 n 231.666672 225.222229 20170413EPA_L03_cell01_c1.spc EPA L03 c 181.000000 181.000000 20170413EPA_L03_cell01_c2.spc EPA L03 c 172.000000 169.888885 20170413EPA_L03_cell01_c3.spc EPA L03 c 168.222229 165.333328 20170410LDL_L01_cell03_n3.spc LDL L01 n 231.666672 222.111099 20170410EDL_L01_cell04_n1.spc EDL L01 n 197.222229 196.333328 20170410EDL_L01_cell04_n3.spc EDL L01 n 206.444443 205.111115 20170410EDL_L01_cell04_c1.spc EDL L01 c 182.777786 180.444443 20170410EDL_L01_cell04_c2.spc EDL L01 c 196.444443 200.444443 20170413EPA_L03_cell02_n1.spc EPA L03 n 198.444443 198.888870 20170413EPA_L03_cell06_n2.spc EPA L03 n 228.666672 212.666672 20170413EPA_L03_cell06_n3.spc EPA L03 n 199.222229 203.444458 20170411EPA_L01_cell03_c1.spc EPA L01 c 186.555557 180.333328 20170411EPA_L01_cell03_c2.spc EPA L01 c 210.666672 204.888885 20170411EPA_L01_cell03_c3.spc EPA L01 c 171.777771 172.444443 20170411STD_L01_cell06_n2.spc STD L01 n 217.555557 216.777771 20170411STD_L01_cell06_c1.spc STD L01 c 171.555557 173.222229 20170411STD_L01_cell06_c2.spc STD L01 c 167.444443 164.111115 20170413LDL_L03_cell07_n1.spc LDL L03 n 236.555557 232.222229 20170413LDL_L03_cell07_n3.spc LDL L03 n 225.333328 233.000000 20170413LDL_L03_cell07_c1.spc LDL L03 c 209.444443 206.666687 420.420746 422.943268 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 272.666656 278.888855 20170410LDL_L01_cell01_n2.spc LDL L01 n 458.111115 463.666656 20170410LDL_L01_cell01_c1.spc LDL L01 c 213.999985 215.777771 20170413EPA_L03_cell07_n2.spc EPA L03 n 271.888885 269.111115 20170413EPA_L03_cell07_n3.spc EPA L03 n 261.222229 263.222229 20170413EPA_L03_cell07_c1.spc EPA L03 c 191.888885 182.666656 20170413LDL_L03_cell05_c1.spc LDL L03 c 189.222229 191.333328 20170413LDL_L03_cell05_c3.spc LDL L03 c 172.111115 181.333328 20170412EDL_L02_cell04_n1.spc EDL L02 n 216.666672 212.222229 20170412EDL_L02_cell04_c1.spc EDL L02 c 176.111115 180.333328 20170412EDL_L02_cell04_c2.spc EDL L02 c 176.111115 180.333328 20170413EDL_L03_cell07_n1.spc EDL L03 n 322.111115 312.222229 20170413EDL_L03_cell07_n2.spc EDL L03 n 237.222229 243.222229 20170413EDL_L03_cell07_c1.spc EDL L03 c 204.333344 204.333313 20170413LDL_L03_cell06_n3.spc LDL L03 n 204.888885 200.888901 20170413LDL_L03_cell06_c1.spc LDL L03 c 170.000000 178.222229 20170413LDL_L03_cell06_c2.spc LDL L03 c 170.666672 176.666672 20170412EDL_L02_cell05_n2.spc EDL L02 n 204.999985 200.777771 20170413LDL_L03_cell06_c3.spc LDL L03 c 208.333328 202.111115 20170411STD_L02_cell07_n1.spc STD L02 n 224.333328 221.222229 20170411STD_L01_cell04_n2.spc STD L01 n 214.444443 213.222229 20170411STD_L01_cell04_n3.spc STD L01 n 184.666672 177.666687 20170411STD_L01_cell04_c3.spc STD L01 c 157.444443 159.222229 20170411STD_L02_cell03_n2.spc STD L02 n 229.111130 225.333328 20170413STD_L03_cell01_n1.spc STD L03 n 229.111115 229.666672 20170413STD_L03_cell01_n2.spc STD L03 n 260.222260 261.444458 20170411STD_L02_cell03_c3.spc STD L02 c 196.222229 195.888885 20170413STD_L03_cell01_c3.spc STD L03 c 192.666656 194.000000 20170413LDL_L03_cell01_c3.spc LDL L03 c 187.777771 188.111115 20170411STD_L02_cell05_n1.spc STD L02 n 254.222229 250.555557 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 291.777771 301.333313 20170411EPA_L01_cell07_n3.spc EPA L01 n 223.666687 226.000000 20170413STD_L03_cell07_c1.spc STD L03 c 180.000000 179.333328 20170413LDL_L03_cell02_c2.spc LDL L03 c 189.666672 186.888885 20170413LDL_L03_cell02_c3.spc LDL L03 c 198.222229 198.222229 20170410LDL_L01_cell06_c3.spc LDL L01 c 169.000000 168.333344 20170410LDL_L01_cell02_n1.spc LDL L01 n 322.333313 334.888855 20170410LDL_L01_cell02_c1.spc LDL L01 c 348.666656 343.000000 20170413EPA_L03_cell01_n1.spc EPA L03 n 254.333328 251.333328 20170413EPA_L03_cell01_n2.spc EPA L03 n 221.888885 222.111115 20170413EPA_L03_cell01_c1.spc EPA L03 c 174.333328 173.777771 20170413EPA_L03_cell01_c2.spc EPA L03 c 162.333328 173.555557 20170413EPA_L03_cell01_c3.spc EPA L03 c 173.888901 171.222229 20170410LDL_L01_cell03_n3.spc LDL L01 n 230.111115 218.555557 20170410EDL_L01_cell04_n1.spc EDL L01 n 202.333328 201.888885 20170410EDL_L01_cell04_n3.spc EDL L01 n 204.555542 203.888901 20170410EDL_L01_cell04_c1.spc EDL L01 c 183.222229 181.777771 20170410EDL_L01_cell04_c2.spc EDL L01 c 193.999985 193.000000 20170413EPA_L03_cell02_n1.spc EPA L03 n 198.111115 200.222229 20170413EPA_L03_cell06_n2.spc EPA L03 n 224.333328 217.888885 20170413EPA_L03_cell06_n3.spc EPA L03 n 197.555557 205.777771 20170411EPA_L01_cell03_c1.spc EPA L01 c 190.000000 181.555557 20170411EPA_L01_cell03_c2.spc EPA L01 c 207.444443 214.222229 20170411EPA_L01_cell03_c3.spc EPA L01 c 175.111115 175.888885 20170411STD_L01_cell06_n2.spc STD L01 n 217.444443 207.444443 20170411STD_L01_cell06_c1.spc STD L01 c 165.888885 165.222214 20170411STD_L01_cell06_c2.spc STD L01 c 163.333328 165.222229 20170413LDL_L03_cell07_n1.spc LDL L03 n 225.555557 232.111099 20170413LDL_L03_cell07_n3.spc LDL L03 n 233.777771 228.666672 20170413LDL_L03_cell07_c1.spc LDL L03 c 206.777786 205.666672 ... 3784.909668 \ filename medium plate comp ... 20170410LDL_L01_cell01_n1.spc LDL L01 n ... 98.935760 20170410LDL_L01_cell01_n2.spc LDL L01 n ... 102.091789 20170410LDL_L01_cell01_c1.spc LDL L01 c ... 99.060684 20170413EPA_L03_cell07_n2.spc EPA L03 n ... 104.405922 20170413EPA_L03_cell07_n3.spc EPA L03 n ... 104.529579 20170413EPA_L03_cell07_c1.spc EPA L03 c ... 106.588158 20170413LDL_L03_cell05_c1.spc LDL L03 c ... 105.306328 20170413LDL_L03_cell05_c3.spc LDL L03 c ... 102.970345 20170412EDL_L02_cell04_n1.spc EDL L02 n ... 103.814987 20170412EDL_L02_cell04_c1.spc EDL L02 c ... 102.062042 20170412EDL_L02_cell04_c2.spc EDL L02 c ... 102.062042 20170413EDL_L03_cell07_n1.spc EDL L03 n ... 106.797691 20170413EDL_L03_cell07_n2.spc EDL L03 n ... 108.615822 20170413EDL_L03_cell07_c1.spc EDL L03 c ... 105.457550 20170413LDL_L03_cell06_n3.spc LDL L03 n ... 97.519386 20170413LDL_L03_cell06_c1.spc LDL L03 c ... 98.715446 20170413LDL_L03_cell06_c2.spc LDL L03 c ... 97.983696 20170412EDL_L02_cell05_n2.spc EDL L02 n ... 105.795158 20170413LDL_L03_cell06_c3.spc LDL L03 c ... 105.176163 20170411STD_L02_cell07_n1.spc STD L02 n ... 110.627029 20170411STD_L01_cell04_n2.spc STD L01 n ... 110.940414 20170411STD_L01_cell04_n3.spc STD L01 n ... 106.181938 20170411STD_L01_cell04_c3.spc STD L01 c ... 103.583786 20170411STD_L02_cell03_n2.spc STD L02 n ... 113.090477 20170413STD_L03_cell01_n1.spc STD L03 n ... 104.816444 20170413STD_L03_cell01_n2.spc STD L03 n ... 107.491089 20170411STD_L02_cell03_c3.spc STD L02 c ... 109.139290 20170413STD_L03_cell01_c3.spc STD L03 c ... 105.018341 20170413LDL_L03_cell01_c3.spc LDL L03 c ... 105.028412 20170411STD_L02_cell05_n1.spc STD L02 n ... 109.543045 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n ... 105.800438 20170411EPA_L01_cell07_n3.spc EPA L01 n ... 103.724518 20170413STD_L03_cell07_c1.spc STD L03 c ... 97.945137 20170413LDL_L03_cell02_c2.spc LDL L03 c ... 101.454880 20170413LDL_L03_cell02_c3.spc LDL L03 c ... 106.495506 20170410LDL_L01_cell06_c3.spc LDL L01 c ... 104.168037 20170410LDL_L01_cell02_n1.spc LDL L01 n ... 106.980110 20170410LDL_L01_cell02_c1.spc LDL L01 c ... 105.599625 20170413EPA_L03_cell01_n1.spc EPA L03 n ... 107.803780 20170413EPA_L03_cell01_n2.spc EPA L03 n ... 108.526428 20170413EPA_L03_cell01_c1.spc EPA L03 c ... 105.956154 20170413EPA_L03_cell01_c2.spc EPA L03 c ... 101.214073 20170413EPA_L03_cell01_c3.spc EPA L03 c ... 102.472000 20170410LDL_L01_cell03_n3.spc LDL L01 n ... 101.530716 20170410EDL_L01_cell04_n1.spc EDL L01 n ... 105.884605 20170410EDL_L01_cell04_n3.spc EDL L01 n ... 92.602135 20170410EDL_L01_cell04_c1.spc EDL L01 c ... 100.366028 20170410EDL_L01_cell04_c2.spc EDL L01 c ... 101.604950 20170413EPA_L03_cell02_n1.spc EPA L03 n ... 101.196892 20170413EPA_L03_cell06_n2.spc EPA L03 n ... 105.323906 20170413EPA_L03_cell06_n3.spc EPA L03 n ... 105.444519 20170411EPA_L01_cell03_c1.spc EPA L01 c ... 108.875954 20170411EPA_L01_cell03_c2.spc EPA L01 c ... 107.302834 20170411EPA_L01_cell03_c3.spc EPA L01 c ... 111.274254 20170411STD_L01_cell06_n2.spc STD L01 n ... 107.752464 20170411STD_L01_cell06_c1.spc STD L01 c ... 107.919830 20170411STD_L01_cell06_c2.spc STD L01 c ... 106.474442 20170413LDL_L03_cell07_n1.spc LDL L03 n ... 107.447830 20170413LDL_L03_cell07_n3.spc LDL L03 n ... 110.121773 20170413LDL_L03_cell07_c1.spc LDL L03 c ... 110.397018 3786.437256 3787.964111 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 97.370834 96.694794 20170410LDL_L01_cell01_n2.spc LDL L01 n 104.197861 99.637276 20170410LDL_L01_cell01_c1.spc LDL L01 c 105.055145 98.716270 20170413EPA_L03_cell07_n2.spc EPA L03 n 104.624397 101.731773 20170413EPA_L03_cell07_n3.spc EPA L03 n 107.747925 105.410721 20170413EPA_L03_cell07_c1.spc EPA L03 c 110.256302 107.368904 20170413LDL_L03_cell05_c1.spc LDL L03 c 102.519356 107.065704 20170413LDL_L03_cell05_c3.spc LDL L03 c 104.852715 103.623962 20170412EDL_L02_cell04_n1.spc EDL L02 n 104.364807 102.914612 20170412EDL_L02_cell04_c1.spc EDL L02 c 106.169197 106.720779 20170412EDL_L02_cell04_c2.spc EDL L02 c 106.169197 106.720779 20170413EDL_L03_cell07_n1.spc EDL L03 n 105.683098 103.568481 20170413EDL_L03_cell07_n2.spc EDL L03 n 114.504448 110.504196 20170413EDL_L03_cell07_c1.spc EDL L03 c 103.008034 104.780746 20170413LDL_L03_cell06_n3.spc LDL L03 n 100.842964 96.944321 20170413LDL_L03_cell06_c1.spc LDL L03 c 102.713333 101.822342 20170413LDL_L03_cell06_c2.spc LDL L03 c 96.307922 98.076584 20170412EDL_L02_cell05_n2.spc EDL L02 n 104.797844 108.467194 20170413LDL_L03_cell06_c3.spc LDL L03 c 104.836159 103.496147 20170411STD_L02_cell07_n1.spc STD L02 n 108.966408 112.083565 20170411STD_L01_cell04_n2.spc STD L01 n 109.377213 111.036232 20170411STD_L01_cell04_n3.spc STD L01 n 105.066833 104.840614 20170411STD_L01_cell04_c3.spc STD L01 c 102.357147 103.352730 20170411STD_L02_cell03_n2.spc STD L02 n 106.756157 114.755180 20170413STD_L03_cell01_n1.spc STD L03 n 104.476692 106.248039 20170413STD_L03_cell01_n2.spc STD L03 n 110.708511 110.703697 20170411STD_L02_cell03_c3.spc STD L02 c 107.249786 106.138062 20170413STD_L03_cell01_c3.spc STD L03 c 103.236855 103.455360 20170413LDL_L03_cell01_c3.spc LDL L03 c 103.910583 103.348297 20170411STD_L02_cell05_n1.spc STD L02 n 107.102615 112.217751 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 102.572540 104.455772 20170411EPA_L01_cell07_n3.spc EPA L01 n 101.384628 103.933632 20170413STD_L03_cell07_c1.spc STD L03 c 99.603455 98.261772 20170413LDL_L03_cell02_c2.spc LDL L03 c 103.669205 101.550201 20170413LDL_L03_cell02_c3.spc LDL L03 c 104.821945 101.815041 20170410LDL_L01_cell06_c3.spc LDL L01 c 103.057091 100.279457 20170410LDL_L01_cell02_n1.spc LDL L01 n 101.302765 104.403191 20170410LDL_L01_cell02_c1.spc LDL L01 c 105.253181 107.573395 20170413EPA_L03_cell01_n1.spc EPA L03 n 104.691223 106.356422 20170413EPA_L03_cell01_n2.spc EPA L03 n 106.079147 109.742973 20170413EPA_L03_cell01_c1.spc EPA L03 c 106.839714 101.056610 20170413EPA_L03_cell01_c2.spc EPA L03 c 110.543266 105.316917 20170413EPA_L03_cell01_c3.spc EPA L03 c 103.467613 102.129890 20170410LDL_L01_cell03_n3.spc LDL L01 n 100.746498 95.740044 20170410EDL_L01_cell04_n1.spc EDL L01 n 105.775375 104.999504 20170410EDL_L01_cell04_n3.spc EDL L01 n 92.810089 94.018051 20170410EDL_L01_cell04_c1.spc EDL L01 c 104.805298 97.689011 20170410EDL_L01_cell04_c2.spc EDL L01 c 105.489159 104.373337 20170413EPA_L03_cell02_n1.spc EPA L03 n 103.525589 105.187622 20170413EPA_L03_cell06_n2.spc EPA L03 n 106.766785 112.320786 20170413EPA_L03_cell06_n3.spc EPA L03 n 101.880959 102.095184 20170411EPA_L01_cell03_c1.spc EPA L01 c 106.986618 109.875084 20170411EPA_L01_cell03_c2.spc EPA L01 c 111.624107 109.834244 20170411EPA_L01_cell03_c3.spc EPA L01 c 111.940483 109.717834 20170411STD_L01_cell06_n2.spc STD L01 n 109.530716 109.420059 20170411STD_L01_cell06_c1.spc STD L01 c 104.473976 103.917007 20170411STD_L01_cell06_c2.spc STD L01 c 106.806175 106.360138 20170413LDL_L03_cell07_n1.spc LDL L03 n 110.563965 107.346741 20170413LDL_L03_cell07_n3.spc LDL L03 n 108.454147 107.342072 20170413LDL_L03_cell07_c1.spc LDL L03 c 106.725052 107.275299 3789.490967 3791.018066 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 96.129852 95.453812 20170410LDL_L01_cell01_n2.spc LDL L01 n 99.743355 101.849426 20170410LDL_L01_cell01_c1.spc LDL L01 c 104.044067 98.705200 20170413EPA_L03_cell07_n2.spc EPA L03 n 105.061371 106.390961 20170413EPA_L03_cell07_n3.spc EPA L03 n 103.962425 105.847450 20170413EPA_L03_cell07_c1.spc EPA L03 c 108.592606 109.816307 20170413LDL_L03_cell05_c1.spc LDL L03 c 99.500969 104.158447 20170413LDL_L03_cell05_c3.spc LDL L03 c 104.395218 99.610909 20170412EDL_L02_cell04_n1.spc EDL L02 n 102.464432 96.903145 20170412EDL_L02_cell04_c1.spc EDL L02 c 103.494583 104.379509 20170412EDL_L02_cell04_c2.spc EDL L02 c 103.494583 104.379509 20170413EDL_L03_cell07_n1.spc EDL L03 n 100.787224 108.672615 20170413EDL_L03_cell07_n2.spc EDL L03 n 110.948387 106.059227 20170413EDL_L03_cell07_c1.spc EDL L03 c 104.220116 101.548370 20170413LDL_L03_cell06_n3.spc LDL L03 n 96.379021 96.369278 20170413LDL_L03_cell06_c1.spc LDL L03 c 106.375801 102.484802 20170413LDL_L03_cell06_c2.spc LDL L03 c 95.845245 97.725021 20170412EDL_L02_cell05_n2.spc EDL L02 n 107.469879 107.694778 20170413LDL_L03_cell06_c3.spc LDL L03 c 103.600586 100.482796 20170411STD_L02_cell07_n1.spc STD L02 n 110.756271 112.651199 20170411STD_L01_cell04_n2.spc STD L01 n 105.361938 109.909851 20170411STD_L01_cell04_n3.spc STD L01 n 101.836632 103.610397 20170411STD_L01_cell04_c3.spc STD L01 c 105.126076 103.788322 20170411STD_L02_cell03_n2.spc STD L02 n 108.531998 110.086571 20170413STD_L03_cell01_n1.spc STD L03 n 103.797188 104.124100 20170413STD_L03_cell01_n2.spc STD L03 n 114.698906 105.249664 20170411STD_L02_cell03_c3.spc STD L02 c 106.470772 104.914604 20170413STD_L03_cell01_c3.spc STD L03 c 104.673866 101.447945 20170413LDL_L03_cell01_c3.spc LDL L03 c 100.563805 103.223732 20170411STD_L02_cell05_n1.spc STD L02 n 109.999557 111.892456 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 107.116783 101.555565 20170411EPA_L01_cell07_n3.spc EPA L01 n 100.815964 105.698303 20170413STD_L03_cell07_c1.spc STD L03 c 99.475662 98.800659 20170413LDL_L03_cell02_c2.spc LDL L03 c 102.431198 104.756645 20170413LDL_L03_cell02_c3.spc LDL L03 c 94.808151 102.356812 20170410LDL_L01_cell06_c3.spc LDL L01 c 108.168495 99.946442 20170410LDL_L01_cell02_n1.spc LDL L01 n 104.948059 106.381828 20170410LDL_L01_cell02_c1.spc LDL L01 c 106.893600 109.436035 20170413EPA_L03_cell01_n1.spc EPA L03 n 110.243858 107.464630 20170413EPA_L03_cell01_n2.spc EPA L03 n 106.740150 107.959534 20170413EPA_L03_cell01_c1.spc EPA L03 c 101.162392 107.268173 20170413EPA_L03_cell01_c2.spc EPA L03 c 106.312790 105.975319 20170413EPA_L03_cell01_c3.spc EPA L03 c 108.569946 107.898895 20170410LDL_L01_cell03_n3.spc LDL L01 n 101.289146 98.616035 20170410EDL_L01_cell04_n1.spc EDL L01 n 107.668060 106.781067 20170410EDL_L01_cell04_n3.spc EDL L01 n 93.448227 95.322845 20170410EDL_L01_cell04_c1.spc EDL L01 c 107.128288 102.012001 20170410EDL_L01_cell04_c2.spc EDL L01 c 105.368660 106.586174 20170413EPA_L03_cell02_n1.spc EPA L03 n 101.071877 107.845024 20170413EPA_L03_cell06_n2.spc EPA L03 n 105.652557 107.095436 20170413EPA_L03_cell06_n3.spc EPA L03 n 99.642738 100.412514 20170411EPA_L01_cell03_c1.spc EPA L01 c 108.652420 107.540886 20170411EPA_L01_cell03_c2.spc EPA L01 c 112.155502 110.254532 20170411EPA_L01_cell03_c3.spc EPA L01 c 106.050728 108.939194 20170411STD_L01_cell06_n2.spc STD L01 n 106.087204 113.643234 20170411STD_L01_cell06_c1.spc STD L01 c 108.248924 103.025284 20170411STD_L01_cell06_c2.spc STD L01 c 109.025215 104.468063 20170413LDL_L03_cell07_n1.spc LDL L03 n 108.018410 110.467865 20170413LDL_L03_cell07_n3.spc LDL L03 n 111.118889 109.340141 20170413LDL_L03_cell07_c1.spc LDL L03 c 106.269989 107.820244 3792.543945 3794.069336 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 97.222229 97.323952 20170410LDL_L01_cell01_n2.spc LDL L01 n 101.955498 101.172699 20170410LDL_L01_cell01_c1.spc LDL L01 c 102.255219 102.471909 20170413EPA_L03_cell07_n2.spc EPA L03 n 101.165016 101.494591 20170413EPA_L03_cell07_n3.spc EPA L03 n 106.621361 105.061943 20170413EPA_L03_cell07_c1.spc EPA L03 c 106.262245 106.597061 20170413LDL_L03_cell05_c1.spc LDL L03 c 100.704796 106.028938 20170413LDL_L03_cell05_c3.spc LDL L03 c 103.937721 99.264519 20170412EDL_L02_cell04_n1.spc EDL L02 n 103.675179 105.558334 20170412EDL_L02_cell04_c1.spc EDL L02 c 102.486641 105.038231 20170412EDL_L02_cell04_c2.spc EDL L02 c 102.486641 105.038231 20170413EDL_L03_cell07_n1.spc EDL L03 n 106.891342 103.221191 20170413EDL_L03_cell07_n2.spc EDL L03 n 112.947868 107.058731 20170413EDL_L03_cell07_c1.spc EDL L03 c 100.876625 102.982674 20170413LDL_L03_cell06_n3.spc LDL L03 n 98.692863 99.349770 20170413LDL_L03_cell06_c1.spc LDL L03 c 102.149361 100.369476 20170413LDL_L03_cell06_c2.spc LDL L03 c 100.604797 100.817902 20170412EDL_L02_cell05_n2.spc EDL L02 n 105.808578 108.255714 20170413LDL_L03_cell06_c3.spc LDL L03 c 102.809456 104.469452 20170411STD_L02_cell07_n1.spc STD L02 n 107.101692 109.663300 20170411STD_L01_cell04_n2.spc STD L01 n 104.568871 109.227898 20170411STD_L01_cell04_n3.spc STD L01 n 101.828651 104.491310 20170411STD_L01_cell04_c3.spc STD L01 c 106.561684 103.779488 20170411STD_L02_cell03_n2.spc STD L02 n 110.530037 112.751282 20170413STD_L03_cell01_n1.spc STD L03 n 106.562126 104.777924 20170413STD_L03_cell01_n2.spc STD L03 n 112.244873 114.017830 20170411STD_L02_cell03_c3.spc STD L02 c 110.358437 106.913391 20170413STD_L03_cell01_c3.spc STD L03 c 102.333138 102.662750 20170413LDL_L03_cell01_c3.spc LDL L03 c 103.772568 104.099182 20170411STD_L02_cell05_n1.spc STD L02 n 110.340919 112.678284 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 105.438789 108.433128 20170411EPA_L01_cell07_n3.spc EPA L01 n 99.691750 104.796295 20170413STD_L03_cell07_c1.spc STD L03 c 101.014542 99.561745 20170413LDL_L03_cell02_c2.spc LDL L03 c 100.415421 105.740860 20170413LDL_L03_cell02_c3.spc LDL L03 c 97.238800 101.454124 20170410LDL_L01_cell06_c3.spc LDL L01 c 101.724373 101.835625 20170410LDL_L01_cell02_n1.spc LDL L01 n 107.371147 103.582687 20170410LDL_L01_cell02_c1.spc LDL L01 c 108.978477 103.520920 20170413EPA_L03_cell01_n1.spc EPA L03 n 105.796509 106.461723 20170413EPA_L03_cell01_n2.spc EPA L03 n 106.734467 107.176071 20170413EPA_L03_cell01_c1.spc EPA L03 c 106.596184 101.146400 20170413EPA_L03_cell01_c2.spc EPA L03 c 106.748970 104.078163 20170413EPA_L03_cell01_c3.spc EPA L03 c 102.450066 102.334557 20170410LDL_L01_cell03_n3.spc LDL L01 n 97.831802 102.047577 20170410EDL_L01_cell04_n1.spc EDL L01 n 105.227402 105.007072 20170410EDL_L01_cell04_n3.spc EDL L01 n 94.308586 97.849861 20170410EDL_L01_cell04_c1.spc EDL L01 c 101.340149 106.446083 20170410EDL_L01_cell04_c2.spc EDL L01 c 105.248154 108.243469 20170413EPA_L03_cell02_n1.spc EPA L03 n 100.507065 100.502434 20170413EPA_L03_cell06_n2.spc EPA L03 n 106.760559 106.759003 20170413EPA_L03_cell06_n3.spc EPA L03 n 102.515633 101.952072 20170411EPA_L01_cell03_c1.spc EPA L01 c 106.873772 106.984444 20170411EPA_L01_cell03_c2.spc EPA L01 c 110.353577 111.119270 20170411EPA_L01_cell03_c3.spc EPA L01 c 109.716522 106.382767 20170411STD_L01_cell06_n2.spc STD L01 n 110.532593 109.310844 20170411STD_L01_cell06_c1.spc STD L01 c 104.912750 102.689117 20170411STD_L01_cell06_c2.spc STD L01 c 105.577576 107.909325 20170413LDL_L03_cell07_n1.spc LDL L03 n 106.361763 108.366768 20170413LDL_L03_cell07_n3.spc LDL L03 n 109.116959 106.338219 20170413LDL_L03_cell07_c1.spc LDL L03 c 112.037163 110.142960 3795.594482 3797.119141 \ filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 93.425697 95.749657 20170410LDL_L01_cell01_n2.spc LDL L01 n 101.612099 104.051521 20170410LDL_L01_cell01_c1.spc LDL L01 c 100.910805 103.683052 20170413EPA_L03_cell07_n2.spc EPA L03 n 107.157532 105.042671 20170413EPA_L03_cell07_n3.spc EPA L03 n 106.280304 103.832001 20170413EPA_L03_cell07_c1.spc EPA L03 c 102.820763 108.155586 20170413LDL_L03_cell05_c1.spc LDL L03 c 101.019737 101.232758 20170413LDL_L03_cell05_c3.spc LDL L03 c 102.258003 104.584793 20170412EDL_L02_cell04_n1.spc EDL L02 n 107.774826 103.102417 20170412EDL_L02_cell04_c1.spc EDL L02 c 102.478714 105.252525 20170412EDL_L02_cell04_c2.spc EDL L02 c 102.478714 105.252525 20170413EDL_L03_cell07_n1.spc EDL L03 n 103.884354 104.436424 20170413EDL_L03_cell07_n2.spc EDL L03 n 107.058464 110.169312 20170413EDL_L03_cell07_c1.spc EDL L03 c 103.533142 102.305855 20170413LDL_L03_cell06_n3.spc LDL L03 n 98.673355 97.996948 20170413LDL_L03_cell06_c1.spc LDL L03 c 102.478485 103.143044 20170413LDL_L03_cell06_c2.spc LDL L03 c 98.586555 100.133018 20170412EDL_L02_cell05_n2.spc EDL L02 n 107.258392 106.149971 20170413LDL_L03_cell06_c3.spc LDL L03 c 100.685005 102.233887 20170411STD_L02_cell07_n1.spc STD L02 n 110.113785 114.786491 20170411STD_L01_cell04_n2.spc STD L01 n 107.220268 104.657066 20170411STD_L01_cell04_n3.spc STD L01 n 105.820656 104.038895 20170411STD_L01_cell04_c3.spc STD L01 c 103.330620 100.659546 20170411STD_L02_cell03_n2.spc STD L02 n 107.639206 111.527115 20170413STD_L03_cell01_n1.spc STD L03 n 100.882622 104.320648 20170413STD_L03_cell01_n2.spc STD L03 n 112.235252 106.563789 20170411STD_L02_cell03_c3.spc STD L02 c 107.468323 106.467712 20170413STD_L03_cell01_c3.spc STD L03 c 105.214600 105.877548 20170413LDL_L03_cell01_c3.spc LDL L03 c 104.648018 102.863518 20170411STD_L02_cell05_n1.spc STD L02 n 108.571198 110.130760 ... ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 102.094124 107.310699 20170411EPA_L01_cell07_n3.spc EPA L01 n 103.234184 105.005417 20170413STD_L03_cell07_c1.spc STD L03 c 100.108963 96.211731 20170413LDL_L03_cell02_c2.spc LDL L03 c 100.399628 101.169518 20170413LDL_L03_cell02_c3.spc LDL L03 c 105.113892 100.218109 20170410LDL_L01_cell06_c3.spc LDL L01 c 101.502441 100.058151 20170410LDL_L01_cell02_n1.spc LDL L01 n 102.794228 102.339104 20170410LDL_L01_cell02_c1.spc LDL L01 c 99.730019 104.828003 20170413EPA_L03_cell01_n1.spc EPA L03 n 106.571388 106.903259 20170413EPA_L03_cell01_n2.spc EPA L03 n 104.284355 110.614853 20170413EPA_L03_cell01_c1.spc EPA L03 c 109.474411 100.691315 20170413EPA_L03_cell01_c2.spc EPA L03 c 107.074028 108.625458 20170413EPA_L03_cell01_c3.spc EPA L03 c 103.219063 101.992455 20170410LDL_L01_cell03_n3.spc LDL L01 n 100.818901 100.145782 20170410EDL_L01_cell04_n1.spc EDL L01 n 105.897850 104.899742 20170410EDL_L01_cell04_n3.spc EDL L01 n 95.946716 97.154671 20170410EDL_L01_cell04_c1.spc EDL L01 c 100.885353 102.991280 20170410EDL_L01_cell04_c2.spc EDL L01 c 99.460999 103.567421 20170413EPA_L03_cell02_n1.spc EPA L03 n 105.720016 104.604271 20170413EPA_L03_cell06_n2.spc EPA L03 n 108.090759 109.978104 20170413EPA_L03_cell06_n3.spc EPA L03 n 96.944077 99.602745 20170411EPA_L01_cell03_c1.spc EPA L01 c 105.206245 108.094688 20170411EPA_L01_cell03_c2.spc EPA L01 c 106.551628 110.428452 20170411EPA_L01_cell03_c3.spc EPA L01 c 109.160118 106.048569 20170411STD_L01_cell06_n2.spc STD L01 n 106.644661 110.311798 20170411STD_L01_cell06_c1.spc STD L01 c 104.243263 107.908501 20170411STD_L01_cell06_c2.spc STD L01 c 106.463287 105.683914 20170413LDL_L03_cell07_n1.spc LDL L03 n 106.927330 109.932335 20170413LDL_L03_cell07_n3.spc LDL L03 n 108.781700 106.225166 20170413LDL_L03_cell07_c1.spc LDL L03 c 111.359879 104.354584 3798.643555 filename medium plate comp 20170410LDL_L01_cell01_n1.spc LDL L01 n 96.740280 20170410LDL_L01_cell01_n2.spc LDL L01 n 103.046486 20170410LDL_L01_cell01_c1.spc LDL L01 c 96.344177 20170413EPA_L03_cell07_n2.spc EPA L03 n 105.816727 20170413EPA_L03_cell07_n3.spc EPA L03 n 106.717010 20170413EPA_L03_cell07_c1.spc EPA L03 c 106.045967 20170413LDL_L03_cell05_c1.spc LDL L03 c 99.334679 20170413LDL_L03_cell05_c3.spc LDL L03 c 101.800484 20170412EDL_L02_cell04_n1.spc EDL L02 n 103.652229 20170412EDL_L02_cell04_c1.spc EDL L02 c 105.915222 20170412EDL_L02_cell04_c2.spc EDL L02 c 105.915222 20170413EDL_L03_cell07_n1.spc EDL L03 n 105.321831 20170413EDL_L03_cell07_n2.spc EDL L03 n 108.502388 20170413EDL_L03_cell07_c1.spc EDL L03 c 102.189667 20170413LDL_L03_cell06_n3.spc LDL L03 n 98.431641 20170413LDL_L03_cell06_c1.spc LDL L03 c 101.585381 20170413LDL_L03_cell06_c2.spc LDL L03 c 96.457222 20170412EDL_L02_cell05_n2.spc EDL L02 n 103.819313 20170413LDL_L03_cell06_c3.spc LDL L03 c 101.338341 20170411STD_L02_cell07_n1.spc STD L02 n 107.903648 20170411STD_L01_cell04_n2.spc STD L01 n 108.538307 20170411STD_L01_cell04_n3.spc STD L01 n 106.368233 20170411STD_L01_cell04_c3.spc STD L01 c 104.321785 20170411STD_L02_cell03_n2.spc STD L02 n 110.192810 20170413STD_L03_cell01_n1.spc STD L03 n 105.314232 20170413STD_L03_cell01_n2.spc STD L03 n 110.781212 20170411STD_L02_cell03_c3.spc STD L02 c 107.244873 20170413STD_L03_cell01_c3.spc STD L03 c 98.540520 20170413LDL_L03_cell01_c3.spc LDL L03 c 104.856796 20170411STD_L02_cell05_n1.spc STD L02 n 109.245895 ... ... 20170413LDL_L03_cell02_n1.spc LDL L03 n 105.860580 20170411EPA_L01_cell07_n3.spc EPA L01 n 103.776634 20170413STD_L03_cell07_c1.spc STD L03 c 102.536720 20170413LDL_L03_cell02_c2.spc LDL L03 c 97.939407 20170413LDL_L03_cell02_c3.spc LDL L03 c 103.988991 20170410LDL_L01_cell06_c3.spc LDL L01 c 106.724968 20170410LDL_L01_cell02_n1.spc LDL L01 n 103.550636 20170410LDL_L01_cell02_c1.spc LDL L01 c 104.148216 20170413EPA_L03_cell01_n1.spc EPA L03 n 105.679573 20170413EPA_L03_cell01_n2.spc EPA L03 n 106.389786 20170413EPA_L03_cell01_c1.spc EPA L03 c 104.352638 20170413EPA_L03_cell01_c2.spc EPA L03 c 104.732430 20170413EPA_L03_cell01_c3.spc EPA L03 c 104.988060 20170410LDL_L01_cell03_n3.spc LDL L01 n 99.583786 20170410EDL_L01_cell04_n1.spc EDL L01 n 109.901634 20170410EDL_L01_cell04_n3.spc EDL L01 n 92.029289 20170410EDL_L01_cell04_c1.spc EDL L01 c 98.875000 20170410EDL_L01_cell04_c2.spc EDL L01 c 104.784950 20170413EPA_L03_cell02_n1.spc EPA L03 n 104.155212 20170413EPA_L03_cell06_n2.spc EPA L03 n 108.198776 20170413EPA_L03_cell06_n3.spc EPA L03 n 95.816971 20170411EPA_L01_cell03_c1.spc EPA L01 c 107.205368 20170411EPA_L01_cell03_c2.spc EPA L01 c 110.749710 20170411EPA_L01_cell03_c3.spc EPA L01 c 107.937019 20170411STD_L01_cell06_n2.spc STD L01 n 107.312279 20170411STD_L01_cell06_c1.spc STD L01 c 105.351532 20170411STD_L01_cell06_c2.spc STD L01 c 103.015663 20170413LDL_L03_cell07_n1.spc LDL L03 n 107.937340 20170413LDL_L03_cell07_n3.spc LDL L03 n 111.335320 20170413LDL_L03_cell07_c1.spc LDL L03 c 109.015938 [504 rows x 1732 columns]>
import matplotlib.pyplot as plt
%matplotlib inline
plt.plot(df.groupby('medium').mean().T)
plt.show()
from sklearn.decomposition import PCA
pca = PCA()
pca.fit(spectrum)
PCA(copy=True, iterated_power='auto', n_components=None, random_state=None, svd_solver='auto', tol=0.0, whiten=False)
wavelength=list_raman[0].wavelength
plt.plot(wavelength,pca.components_[:2].T)
plt.show()
plt.plot(pca.explained_variance_ratio_[0:5])
plt.show()
from sklearn.preprocessing import StandardScaler
from sklearn.pipeline import make_pipeline
pca_norm = make_pipeline(StandardScaler(), PCA(n_components=6, whiten=True))
pca = PCA(n_components=6, whiten=True)
X_r = pca.fit_transform(spectrum)
X_r = pca_norm.fit_transform(spectrum)
print(X_r.shape)
(504, 6)
plt.plot(wavelength,pca.components_[0].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.show()
plt.plot(wavelength,pca.components_[1].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.show()
plt.plot(wavelength,pca.components_[2].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.show()
plt.plot(wavelength,pca.components_[3].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.show()
plt.plot(wavelength,pca.components_[4].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.axvspan(1350, 1400, alpha=0.2, color='grey')
plt.show()
plt.plot(wavelength,pca.components_[5].T)
plt.axvspan(1000, 1200, alpha=0.2, color='grey')
plt.show()
for medium in metadata['medium'].unique() :
mask = metadata['medium'] == medium
plt.scatter(X_r[mask, 0], X_r[mask, 1],
label=medium, s=5, alpha=0.7)
plt.legend()
plt.show()
plt.scatter(X_r[:, 0], X_r[:, 1])
plt.show()
from specio.core.util import Spectrum
wavelength = dict_raman["EDL"][0].wavelength
spectrum = np.array([sp.amplitudes for sp in dict_raman["EDL"]])
inst_spect = Spectrum(amplitudes=spectrum, wavelength=wavelength, meta=None)
print(inst_spect)
Spectrum: wavelength: [ 400.20645142 402.73706055 405.26681519 ... 3795.69213867 3797.21679688 3798.74194336] amplitudes: [[210.1111145 216.55555725 222. ... 107.77482605 103.10241699 103.65222931] [175.00001526 179.1111145 178.66667175 ... 102.47871399 105.25252533 105.91522217] [175.00001526 179.1111145 178.66667175 ... 102.47871399 105.25252533 105.91522217] ... [187.66667175 204.777771 209.8888855 ... 95.94671631 97.15467072 92.02928925] [163.99998474 180.99998474 177.44444275 ... 100.88535309 102.9912796 98.875 ] [189.1111145 197.55557251 198.8888855 ... 99.46099854 103.56742096 104.78495026]] metadata: {}
plt.plot(inst_spect.wavelength, inst_spect.amplitudes.T)
plt.show()
from scipy.misc import derivative
f=lambda x : np.exp(-x)*np.sin(x)
second=derivative(f,spectrum[0,:],n=2)
plt.plot(wavelength,second)
[<matplotlib.lines.Line2D at 0x7f51d4a745c0>]