[gmx-users] charmm to gromacs nonbonded parameters after conversion

Hi GMX users, I would like to perform MD with new developped CHARMM parameters in GROMACS. Since these parameters are new, they are not presents in the ffcharm*.itp files given in the of charmm27.ff in the latest GMX distribution. So I have already made the conversions for the bonded

Re: [gmx-users] charmm to gromacs nonbonded parameters after conversion

- Original Message - From: ABEL Stephane 175950 stephane.a...@cea.fr Date: Monday, September 13, 2010 2:59 Subject: [gmx-users] charmm to gromacs nonbonded parameters after conversion To: gmx-users@gromacs.org Hi GMX users, I would like to perform MD with new developped CHARMM