[gmx-developers] Missing residue info of NLE in charmm22-star forcefield

Hongbin Wan tuf74538 at temple.edu
Mon Oct 24 22:55:20 CEST 2016


Hi,

I am trying to set up simulations with charmm22-star forcefield, and I
found out that it did not include NLE residue info.
Could anyone tell me where to find it or how to add it to Gromacs? Thanks a
lot.

Best,
-- 
Hongbin Wan

*Department of Chemistry*

*130 Beury Hall*

*1901 N 13th Street*

*Philadelphia, PA 19122*

Email: tuf74538 at temple.edu
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