Shun Sakuraba
- Email: sakuraba@nmr.kuicr.kyoto-u.ac.jp
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- Last connection: 03/22/2011
Issues
Activity
10/18/2010
- 06:51 AM GROMACS Bug #595: gromos43a1.ff/methanol.itp has incompatible atom type "CMET" and "OMET"
- Created an attachment (id=558)
Topology file to reproduce
Reading this file with grompp will reproduce the bug. - 06:50 AM GROMACS Bug #595 (Closed): gromos43a1.ff/methanol.itp has incompatible atom type "CMET" and "OMET"
- Created an attachment (id=557)
Patch to methanol.itp
From GROMACS version 4.5, gromos43a1 force field uses "CMet" at...
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