[gmx-users] Re: installing CGenFF in Gromacs

2013-04-09 Thread jbermudez
I'll check out chapter 5. And look for those scripts that you mention. Thanks Justin! -- View this message in context: http://gromacs.5086.x6.nabble.com/installing-CGenFF-in-Gromacs-tp5007103p5007157.html Sent from the GROMACS Users Forum mailing list archive at Nabble.com. -- gmx-users

[gmx-users] installing CGenFF in Gromacs

2013-04-08 Thread jbermudez
Hi! I'm interested in using CHARMM's General Force Field for organic molecules (CGenFF) in Gromacs. For that, I've downloaded the files top_all36_cgenff.rtf, par_all36_cgenff.prm (from http://mackerell.umaryland.edu/~kenno/cgenff/) which, correspond to the topology and parameters files