[gmx-users] Script for prodrg+gromacs

[Spiwok Vojtech]

Dear Gromacs users/developers

A small perl script designed to attach a PRODRG-generated
coordinate file to a coordinate file generated by pdb2gmx
can be downloaded on:

http://biomikro.vscht.cz/groups/lab211/adresar/addprodrg.pl

The usage is:
>./addprodrg.pl protein.gro ligand.gro > complex.gro

It - updates total number of atoms
   - appends coordinates of the ligand
   - updates residue and atom numbers of the ligand
   - moves the line with box-size-info to the end

It's nothing big but could help. 
Perl gurus must appologize my floppy perl-ing.

Vojtech Spiwok
ICT Prague