Hi all, I have a small problem with pdb2gmx. I have a non-standard residue with rtp parameters entered manually into oplsaa database. When I try to convert my pdb file into gro, I get: ------------------------------------- Program pdb2gmx, VERSION 3.3.1 Source code file: toputil.c, line: 94
Fatal error: Increase MAXSLEN in src/kernel/grompp.h to at least 35, or shorten your definition of bonds like 2.87441 0.58158 2.092 -5.54799 0 0 to at most 31 ------------------------------------- Mentioned line is one of my RB dihedral parameters. I got the same problem with gromacs 3.2.1, but I dont know how I got rid of it. I also could not find grompp.h in the mentioned location. I cannot truncate my parameters in order to fit for 31 character-space, so I am clueless. I will appreciate any help. Thanks in advance. Murat Cetinkaya _______________________________________________ gmx-users mailing list gmx-users@gromacs.org http://www.gromacs.org/mailman/listinfo/gmx-users 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
