subject:"\[gmx\-users\] TOPOLOGY USING OPLS FORCEFIELD"

Re: [gmx-users] TOPOLOGY USING OPLS FORCEFIELD

2017-08-06 Thread Nikhil Maroli

Hi, You need to insert ligand/small molecule information in top file, follow the tutorial http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin/gmx-tutorials/complex/02_topology.html -- Gromacs Users mailing list * Please search the archive at

[gmx-users] TOPOLOGY USING OPLS FORCEFIELD

2017-08-06 Thread Vidya R

Hi gromacs users, After getting the output from topolbuild, how to construct topology file using opls forcefield? Can anyone send useful links for the same? Thanks, Vidya.R -- Gromacs Users mailing list * Please search the archive at