e.net
cc:
Subject: [PyMOL] SEPs in pymol generated pqr
What is the recommended approach with apbs for creating a pqr file
from a pdb which has SEP residues? Under gromacs I have been able to
do MD on this peptide by using the user donated ffG43a1p force field which
suppor
ge.net
> [mailto:pymol-users-ad...@lists.sourceforge.net] On Behalf Of
> Jack Howarth
> Sent: Thursday, April 14, 2005 3:45 PM
> To: pymol-users@lists.sourceforge.net
> Subject: [PyMOL] SEPs in pymol generated pqr
>
> What is the recommended approach with apbs for creating
> a
What is the recommended approach with apbs for creating a pqr file
from a pdb which has SEP residues? Under gromacs I have been able to
do MD on this peptide by using the user donated ffG43a1p force field which
supports phosphoserine residues. Unfortunately none of the force fields
available a
