diff --git a/tools/ADC25generator.py b/tools/ADC25generator.py index 5ca0cd6c..c7ef0d41 100755 --- a/tools/ADC25generator.py +++ b/tools/ADC25generator.py @@ -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