Skip to content
GitLab
Menu
Projects
Groups
Snippets
Loading...
Help
Help
Support
Community forum
Keyboard shortcuts
?
Submit feedback
Contribute to GitLab
Sign in
Toggle navigation
Menu
Open sidebar
tsoc
openmm
Commits
ce042c89
Commit
ce042c89
authored
Dec 08, 2015
by
Rafal P. Wiewiora
Browse files
is not None
parent
f2fc1353
Changes
1
Hide whitespace changes
Inline
Side-by-side
Showing
1 changed file
with
1 addition
and
1 deletion
+1
-1
wrappers/python/simtk/openmm/app/pdbfile.py
wrappers/python/simtk/openmm/app/pdbfile.py
+1
-1
No files found.
wrappers/python/simtk/openmm/app/pdbfile.py
View file @
ce042c89
...
...
@@ -162,7 +162,7 @@ class PDBFile(object):
i
=
connect
[
0
]
for
j
in
connect
[
1
:]:
if
i
in
atomByNumber
and
j
in
atomByNumber
:
if
atomByNumber
[
i
].
element
!=
None
and
atomByNumber
[
j
].
element
!=
None
:
if
atomByNumber
[
i
].
element
is
not
None
and
atomByNumber
[
j
].
element
is
not
None
:
if
atomByNumber
[
i
].
element
.
symbol
in
metalElements
or
atomByNumber
[
j
].
element
.
symbol
in
metalElements
:
if
atomByNumber
[
i
].
residue
==
atomByNumber
[
j
].
residue
:
connectBonds
.
append
((
atomByNumber
[
i
],
atomByNumber
[
j
]))
...
...
Write
Preview
Markdown
is supported
0%
Try again
or
attach a new file
.
Attach a file
Cancel
You are about to add
0
people
to the discussion. Proceed with caution.
Finish editing this message first!
Cancel
Please
register
or
sign in
to comment