Use editconf to change gro file type to pdb file. On Wed, Sep 9, 2009 at 8:29 PM, Amit Choubey <[email protected]> wrote:
> hi everyone, > I have a pdb file of my system and i want it to be fed into the GROMACS > software. I have a new force field for the simulation and i have made the > .top file manually which includes the new library FF files. I need to get a > .gro file from the .pdb file that i have. So, is there a way out to do this > without incorporating pdb2gmx because i dont use the standard FF and i dont > really have all the other datafiles for the new FF except for necessary bond > and nonbonded infos. > > Amit > > _______________________________________________ > gmx-users mailing list [email protected] > http://lists.gromacs.org/mailman/listinfo/gmx-users > Please search the archive at http://www.gromacs.org/search before posting! > Please don't post (un)subscribe requests to the list. Use the > www interface or send it to [email protected]. > Can't post? Read http://www.gromacs.org/mailing_lists/users.php >
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