[gmx-users] HB3 ATOM
jalemkul at vt.edu
Mon Sep 3 20:18:50 CEST 2018
On 9/3/18 6:27 AM, Mahdi Sobati Nezhad wrote:
> my pdb file named HB2 and HB3 but .rtp file in my force field named HB1and
> HB2. and so on error "atom HB3 in residue xxx was not found in rtp entry"
> can I rename HB2 to HB1 and HB3 to HB2 ?
> or any idea?!
Have you tried it?
Justin A. Lemkul, Ph.D.
Virginia Tech Department of Biochemistry
303 Engel Hall
340 West Campus Dr.
Blacksburg, VA 24061
jalemkul at vt.edu | (540) 231-3129
More information about the gromacs.org_gmx-users