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parser-charmm
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nomad-lab
parser-charmm
Commits
68150645
Commit
68150645
authored
Mar 31, 2018
by
Berk Onat
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Cleaning the parser code
parent
73c7a894
Pipeline
#26701
failed with stage
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parser/parser-charmm/CHARMMParser.py
parser/parser-charmm/CHARMMParser.py
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parser/parser-charmm/CHARMMParser.py
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68150645
...
...
@@ -760,11 +760,6 @@ class CHARMMParser(SmartParser.ParserBase):
#self.MDData.initializeFileHandlers(self)
#if self.outputcoords:
# self.outputpositions = self.outputcoords.positions()
#self.MDiter += self.MDstep
#self.MDiter += 1
#self.MDcurrentstep = int(self.MDiter)
#self.stepcontrolDict.update({"MDcurrentstep" : int(self.MDcurrentstep)})
#pass
def
onOpen_x_charmm_section_control_parameters
(
self
,
backend
,
gIndex
,
section
):
# keep track of the latest section
...
...
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