[gmx-users] shall we use Charmm_t3p water model?

Mark Abraham mark.j.abraham at gmail.com
Sat Nov 24 18:29:19 CET 2012

Check out the Bjelkmar paper that introduced CHARMM27 into GROMACS, cited
from the manual section about CHARMM (hint, hint)


On Sat, Nov 24, 2012 at 5:36 PM, Albert <mailmd2011 at gmail.com> wrote:

> hello:
>   I found that some people use CHARMM27+t3p for their simulation system,
> and some prefer CHARMM27+charmm_t3p. I am just wondering is it necessary to
> use CHARMM_T3P model for a system which introduce CHARMM FF for the
> protein? I found that it is pretty slow to use CHARMM_T3P model.
> thank you very much.
> Albert
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