Re: [gmx-users] GROMOS vs. CHARMM dihedrals

2015-02-24 Thread Justin Lemkul
On 2/24/15 1:19 PM, Bianca Villavicencio wrote: Hi all, I was wondering about interchangeability of proper dihedral parameters between GROMOS and CHARMM force fields. I am building a new, non-proteic residue, and I would like to use parameters from my GROMOS structure for the CHARMM simulation.

[gmx-users] GROMOS vs. CHARMM dihedrals

2015-02-24 Thread Bianca Villavicencio
Hi all, I was wondering about interchangeability of proper dihedral parameters between GROMOS and CHARMM force fields. I am building a new, non-proteic residue, and I would like to use parameters from my GROMOS structure for the CHARMM simulation. Specifically, I would like to use the proper dihedr