[gmx-users] Question about x2top

Jussi Lehtola jussi.lehtola at helsinki.fi
Thu May 8 15:55:07 CEST 2008


Hi,



first of all, thanks to Mark and David for helping me with building
potentials.

Is there any way to speed up x2top? When I have generated a system of
thousands of molecules using genconf and make a topology for it using
x2top, the process can take hours. Is it OK just to copy the
single-molecule topology made by x2top N times for a system of N
molecules?
-- 
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Jussi Lehtola, FM, Tohtorikoulutettava
Fysiikan laitos, Helsingin Yliopisto
jussi.lehtola at helsinki.fi, p. 191 50673
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Mr. Jussi Lehtola, M. Sc., Doctoral Student
Department of Physics, University of Helsinki, Finland
jussi.lehtola at helsinki.fi
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