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

[David van der Spoel]

himanshu khandelia wrote:
> Hi,
> 
> 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
> -------------------------------------------------------

you probably got a warning as well.

> 
> 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
> 
> ----------------------------
> Himanshu Khandelia, PhD,
> Research Assistant Professor (Postdoc),
> MEMPHYS, Center for BioMembrane Physics: www.memphys.sdu.dk 
> <http://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 <mailto:hkhandel at memphys.sdu.dk>, 
> hkhandelia at gmail.com <mailto:hkhandelia at gmail.com>
> -----------------------------
> 
> 
> ------------------------------------------------------------------------
> 
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Professor of Biology
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://folding.bmc.uu.se
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