[gmx-users] Melting temperature of the potato, a bug in grompp?

Xavier Periole X.Periole at rug.nl
Sun May 11 00:23:03 CEST 2008


Dear grompp users,

I can not reproduce the experimental melting temperature of the
potato from the south east of my region! Even at 1 atm, for which
the result is known.

What is wrong with my trajectory?

please help,
XAvier

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XAvier Periole - PhD

NMR & Molecular Dynamics Group
University of Groningen
The Netherlands
http://md.chem.rug.nl/~periole
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