| commit | 93ac68d4a53df4f5289c8de89aa56b275afab18a | |
| author | Berk Hess <hess@kth.se> | |
| Tue, 13 Feb 2018 11:55:35 +0000 (13 12:55 +0100) | ||
| committer | Mark Abraham <mark.j.abraham@gmail.com> | |
| Wed, 14 Feb 2018 08:58:35 +0000 (14 09:58 +0100) | ||
| tree | 3c1ce4790746db8cabc2260668f248a5469ea96c | treesnapshot (tar.gz zip) |
| parent | e76e61a4023e7351a3d9c6d5919cb930ff68d616 | commitdiff |
Fix grompp net charge check
The grompp check for the net charge would ignore molecule blocks
at the end when molecule types are used in multiple, non consecutive
molecule blocks.
Fixes #2407
Change-Id: I4e7c6c609da99025174f180f9d4037ac9f9fd7fc
The grompp check for the net charge would ignore molecule blocks
at the end when molecule types are used in multiple, non consecutive
molecule blocks.
Fixes #2407
Change-Id: I4e7c6c609da99025174f180f9d4037ac9f9fd7fc
| src/gromacs/gmxpreprocess/topio.cpp | diffblobblamehistory |