[gmx-users] Hydrogen virtual sites and AMBER FF

Timofey Tyugashev tyugashev at niboch.nsc.ru
Mon Oct 5 12:48:42 CEST 2015

IIRC, Mark Abraham wrote that there are some issues with implementation 
of vsites with amber ffs in GROMACS.
Any more details? Is it possible to use amber99sb-ildn with -vsite 
option to speed up calculation?

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