[gmx-users] Parameterfile: Unknown left-hand...

David van der Spoel spoel at xray.bmc.uu.se
Mon Mar 18 23:04:32 CET 2002


On Mon, 18 Mar 2002, Mehmet Suezen wrote:

>Dear GRomacs users,
>
>What is the significance of following warning messages?
>
>Back Off! I just backed up mdout.mdp to #mdout.mdp#
>Warning 1 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand coulombtype in parameter file
>
>Warning 2 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand rcoulomb in parameter file
>
>Warning 3 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand vdwtype in parameter file
>
>Warning 4 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand rvdw in parameter file
>
>Warning 5 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand DispCorr in parameter file
>
>Warning 6 [file silica_ttam10ps.mdp, line unknown]:
>  Unknown left-hand anneal in parameter file
>
>What may cause this warnings? Would this has an affect on simulation?

compare to mdout.mdp (use diff) maybe some unreadable character?
attach the parameter file to another mail...

Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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