[gmx-users] (no subject)

Justin A. Lemkul jalemkul at vt.edu
Thu May 31 13:40:25 CEST 2012

On 5/31/12 7:37 AM, Subramaniam Boopathi wrote:
> how to assign charge and charge group number when new residue as being added to
> the existing amino acid rtp file

The details depend on the force field you're using.




Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


More information about the gromacs.org_gmx-users mailing list