[gmx-developers] mdrun not working with VERSION 3.3_beta_20050202

[David van der Spoel]

On Mon, 2005-02-14 at 18:58 +0100, Florian Haberl wrote:

> With more than 1cpu benchmarks always died with an error msg:
> 
> [quote]
> -------------------------------------------------------
> Program mdrun, VERSION 3.3_beta_20050202
> Source code file: ns.c, line: 314
> 
> Fatal error:
> ns.c, 315: Negative number of short range atoms.
> Call your Gromacs dealer for assistance.
> -------------------------------------------------------

I just committed a patch for this problem. Please update src/mdlib/ns.c

-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
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://xray.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++

-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
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://xray.bmc.uu.se/~spoel
++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++++