[gmx-developers] spurious interactions

[David van der Spoel]

Hi,

I just uploaded a new redmine http://redmine.gromacs.org/issues/1791 
about a weird topology where a Van der Waals interaction is computed 
despite all VDW parameters being zero. The interaction is computed 
despite not being in a known neighborlist. Any suggestions where to 
start debugging?

Cheers,
-- 
David van der Spoel, Ph.D., Professor of Biology
Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone:	+46184714205.
spoel at xray.bmc.uu.se    http://folding.bmc.uu.se