[gmx-users] GROMACS 4.0.2 error Value of 'multiplicity' in Proper Dih. is 0,

himanshu khandelia hkhandelia at gmail.com
Tue Jan 13 17:41:19 CET 2009


I am using grompp after installing gromacs 4.0.2, and get the following
error for a single lipid molecule:

Program grompp, VERSION 4.0.2
Source code file: convparm.c, line: 68

Fatal error:
Value of 'multiplicity' in Proper Dih. is 0, which is smaller than the
minimum of 1

I do not get any such error using grompp v. 3.3.3.

Anyone know whats going on ?

The topology looks fine, there is no dihedral with multiplicity 0. Is this a
formatting problem ?

Thank you for the help,


Himanshu Khandelia, PhD,
Research Assistant Professor (Postdoc),
MEMPHYS, Center for BioMembrane Physics: www.memphys.sdu.dk
University of Southern Denmark (SDU)
Campusvej 55, Odense M 5230, Denmark
Phone: +45 6550 3510, +45 2398 7972
Fax: +45 6550 4048
email: hkhandel at memphys.sdu.dk, hkhandelia at gmail.com
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