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may check for 1-4 scaling factors in CHARMM dihedral styles only when…

Authored by Axel Kohlmeyer <akohlmey@gmail.com> on Jun 22 2017, 01:29.

Description

may check for 1-4 scaling factors in CHARMM dihedral styles only when "weightflag" is set, since they may be used with amber

Details

Committed
Axel Kohlmeyer <akohlmey@gmail.com>Jun 22 2017, 01:29
Pushed
jungeOct 19 2017, 09:53
Parents
rLAMMPS612b44a8951e: enforce using 'special_bonds charmm' for dihedral styles charmm and charmmfsw
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Event Timeline

Axel Kohlmeyer <akohlmey@gmail.com> committed rLAMMPS0c6a7517511b: may check for 1-4 scaling factors in CHARMM dihedral styles only when… (authored by Axel Kohlmeyer <akohlmey@gmail.com>).Jun 22 2017, 01:29