Skip to content

GitLab

"...ssh:/git@developer.sourcefind.cn:2222/tsoc/openmm.git" did not exist on "ce8d6a2d9e87e2c7d26b61c43fe68b0458943d53"
Commit 681f601b authored by Peter Eastman's avatar Peter Eastman
Browse files

Fixed bug that caused some TOP files to fail

parent 0307a0db
Hide whitespace changes
Inline Side-by-side
Showing with 1 addition and 1 deletion
wrappers/python/simtk/openmm/app/gromacstopfile.py
View file @ 681f601b
...@@ -576,7 +576,7 @@ class GromacsTopFile(object): ...@@ -576,7 +576,7 @@ class GromacsTopFile(object):
dihedralType = fields[4] dihedralType = fields[4]
reversedTypes = types[::-1]+(dihedralType,) reversedTypes = types[::-1]+(dihedralType,)
types = types+(dihedralType,) types = types+(dihedralType,)
if (dihedralType in ('1', '2') and len(fields) > 7) or (dihedralType == '3' and len(fields) > 10): if (dihedralType in ('1', '2', '4', '9') and len(fields) > 7) or (dihedralType == '3' and len(fields) > 10):
paramsList = [fields] paramsList = [fields]
else: else:
# Look for a matching dihedral type. # Look for a matching dihedral type.
......
Markdown is supported
0% or .
You are about to add 0 people to the discussion. Proceed with caution.
Finish editing this message first!
Please register or to comment