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Fix fluorescence bug in ADC25generator

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This commit is contained in:
Mickaël Véril 2020-09-23 16:22:25 +02:00
parent 27bdd91696
commit 52374904c7
1 changed files with 1 additions and 1 deletions
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2
tools/ADC25generator.py
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@ -84,7 +84,7 @@ for t in DataType:
currdir=datadir/t.name.lower()
for file in currdir.glob("*.dat"):
with file.open('r') as f: # open in readonly mode
dFile = dataFileBase.readFile(f,DataType.ABS)
dFile = dataFileBase.readFile(f,t)
m=ADC23re.match(dFile.method.name)
if m and (sets == None or dFile.set.name in sets and (len(sets[dFile.set.name])==0 or dFile.set.index in sets[dFile.set.name])):
dFiles[int(m.group(1))][dFile.molecule][dFile.method.basis]=dFile