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tsoc
openmm
Commits
35adccb0
Commit
35adccb0
authored
Nov 20, 2015
by
Jason Swails
Browse files
Fix docstring.
parent
9e934f69
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wrappers/python/simtk/openmm/app/amberprmtopfile.py
wrappers/python/simtk/openmm/app/amberprmtopfile.py
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wrappers/python/simtk/openmm/app/amberprmtopfile.py
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35adccb0
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@@ -203,10 +203,10 @@ class AmberPrmtopFile(object):
...
@@ -203,10 +203,10 @@ class AmberPrmtopFile(object):
ewaldErrorTolerance : float=0.0005
ewaldErrorTolerance : float=0.0005
The error tolerance to use if nonbondedMethod is Ewald or PME.
The error tolerance to use if nonbondedMethod is Ewald or PME.
switchDistance : float=0*nanometers
switchDistance : float=0*nanometers
A positive value turns on a
potential energy switching function
for
The distance at which the
potential energy switching function
is
Lennard-Jones interacti
on
s
. If the switchDistance is 0 or evaluates
turned
on. If the switchDistance is 0 or evaluates
to boolean False,
to boolean False,
no switching function will be used.
Illegal values
no switching function will be used.
Values greater than
(e.g.,
less than 0
) will
raise a ValueError
nonbondedCutoff or
less than 0 raise a ValueError
Returns
Returns
-------
-------
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