Please ignore this post. I rectified the problem by using the GMXLIB export.
Thank you very much for all the support
Aswathy
Dept. Biotechnology
Ext. 3108
----- Original Message -----
From: "Ms. Aswathy S" <aswat...@amritapuri.amrita.edu>
To: "gmx-users" <gmx-users@gromacs.org>
Sent: Saturday, June 13, 2009 12:00:11 PM GMT +05:30 Chennai, Kolkata, Mumbai,
New Delhi
Subject: [gmx-users] Error in hdb file ffG43a1.hdb
Hi,
I have upgraded my gromacs version to 3.3.3 from 3.2.1. When I tried to run the
pdb2gmx i got the follo: error. From the previous post I guess that i should
edit this ffG43a1.hdb. but my input is a protein file so ..so is this necessary
or any other way to rectify this problem???
-------------------------------------------------------
Program pdb2gmx_mpi, VERSION 3.3.3
Source code file: h_db.c, line: 95
Fatal error:
Error in hdb file ffG43a1.hdb:
Wrong number of control atoms (2 iso 3) on line:
1 1 N -C CA
Thanks in advance,
Aswathy
Dept. Biotechnology
Ext. 3108
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
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 gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
_______________________________________________
gmx-users mailing list gmx-users@gromacs.org
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 gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/mailing_lists/users.php
