Re: [gmx-users] Regarding generating topology file.

2011-08-19 Thread Bruce D. Ray
On Tuesday, August 2, 2011 at 5:17 AM, Ravi Kumar Venkatraman wrote: > I have got some topology and parameter file for some small organic molecules from swissparam in *.mol2 format. > I am trying to generate *.top, *.gro & *.itp files using topolbuild. But I dont know how to do. So can anybody

Re: [gmx-users] Regarding generating topology file.

2011-08-02 Thread Mark Abraham
On 02/08/11, Ravi Kumar Venkatraman wrote: > Dear all, > I have got some topology and parameter file for some small > organic molecules from swissparam in *.mol2 format. I am trying to generate > *.top, *.gro & *.itp files using topolbuild. But I dont know how to do. So > can an

[gmx-users] Regarding generating topology file.

2011-08-02 Thread Ravi Kumar Venkatraman
Dear all, I have got some topology and parameter file for some small organic molecules from swissparam in *.mol2 format. I am trying to generate *.top, *.gro & *.itp files using topolbuild. But I dont know how to do. So can anybody give me a link or some materials related to this. Tha