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tsoc
openmm
Commits
7e0bd506
Commit
7e0bd506
authored
Jan 18, 2016
by
Rafal P. Wiewiora
Browse files
correction
parent
4f66c0c6
Changes
1
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wrappers/python/simtk/openmm/app/forcefield.py
wrappers/python/simtk/openmm/app/forcefield.py
+1
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wrappers/python/simtk/openmm/app/forcefield.py
View file @
7e0bd506
...
@@ -322,7 +322,7 @@ class ForceField(object):
...
@@ -322,7 +322,7 @@ class ForceField(object):
types
.
append
(
self
.
_atomClasses
[
attrib
[
classAttrib
]])
types
.
append
(
self
.
_atomClasses
[
attrib
[
classAttrib
]])
elif
typeAttrib
in
attrib
:
elif
typeAttrib
in
attrib
:
if
attrib
[
typeAttrib
]
==
''
:
if
attrib
[
typeAttrib
]
==
''
:
types
.
append
(
self
.
_atomClasses
[
''
])
:
types
.
append
(
self
.
_atomClasses
[
''
])
elif
attrib
[
typeAttrib
]
not
in
self
.
_atomTypes
:
elif
attrib
[
typeAttrib
]
not
in
self
.
_atomTypes
:
types
.
append
(
None
)
# Unknown atom type
types
.
append
(
None
)
# Unknown atom type
else
:
else
:
...
...
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