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tsoc
openmm
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0d61baa1
Commit
0d61baa1
authored
May 12, 2014
by
peastman
Browse files
Merge pull request #442 from kyleabeauchamp/tinydocfix
Fixed typo in modeller docstring.
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79ad83b5
99517031
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wrappers/python/simtk/openmm/app/modeller.py
wrappers/python/simtk/openmm/app/modeller.py
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wrappers/python/simtk/openmm/app/modeller.py
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0d61baa1
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@@ -263,7 +263,7 @@ class Modeller(object):
...
@@ -263,7 +263,7 @@ class Modeller(object):
- positiveIon (string='Na+') the type of positive ion to add. Allowed values are 'Cs+', 'K+', 'Li+', 'Na+', and 'Rb+'
- positiveIon (string='Na+') the type of positive ion to add. Allowed values are 'Cs+', 'K+', 'Li+', 'Na+', and 'Rb+'
- negativeIon (string='Cl-') the type of negative ion to add. Allowed values are 'Cl-', 'Br-', 'F-', and 'I-'. Be aware
- negativeIon (string='Cl-') the type of negative ion to add. Allowed values are 'Cl-', 'Br-', 'F-', and 'I-'. Be aware
that not all force fields support all ion types.
that not all force fields support all ion types.
- ionicStr
i
ng (concentration=0*molar) the total concentration of ions (both positive and negative) to add. This
- ionicStr
e
ng
th
(concentration=0*molar) the total concentration of ions (both positive and negative) to add. This
does not include ions that are added to neutralize the system.
does not include ions that are added to neutralize the system.
"""
"""
# Pick a unit cell size.
# Pick a unit cell size.
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