[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
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++
More information about the gromacs.org_gmx-users
mailing list