[gmx-users] Generation of force field for "NME " capping group

nidhi nidhi020191 at gmail.com
Thu Apr 25 15:30:10 CEST 2019


Dear Gromacs users,

I want to capped the end groups of a protein chain with acetyl  (ACE) and
amine  (NME) groups. As I am using gromos96 43A1 force field and NMe is not
present in aminoacid.rtp.
In amber NME is present but not in gromos.

Anyone please suggest something how to generate force field for "Nme" in
gromos.

Regards
Nidhi


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