[gmx-developers] Bug in analysis programs with frame skipping.

ramon at juguete.quim.ucm.es ramon at juguete.quim.ucm.es
Wed Apr 20 11:54:52 CEST 2005

O Wed, Apr 20, 2005 at 12:02:07PM +0200, Berk Hess wrote:
> ramon at juguete.quim.ucm.es wrote:
> In general it should not be necessary to use double precision
> analysis tools on single precision trajectories though.

The problem happened with a xtc trajectory generated by double precision
mdrun. Apparently the timestep was stored as single precision.

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