LAMMPS WWW Site - LAMMPS Documentation - LAMMPS Mailing List Archives
Re: [lammps-users] converting pdb to lammps data file
[Date Prev][Date Next][Thread Prev][Thread Next][Date Index][Thread Index]

Re: [lammps-users] converting pdb to lammps data file


From: "R. Varsha" <varsharani.0909@...24...>
Date: Mon, 18 Sep 2017 16:20:36 +0530

Hello Neda,

Yes you can create lammps data file from your pdb via topotools. First you have to load that pdb file in vmd and then open tk console and give the following command -
topo writelammpsdata <output filename> <atom-style>

for e.g.
topo writelammpsdata lmp.data full


Regards
Varsha