Dear all,
I would like to continue polarizable simulations previously simulated with
another md program. That program uses 1-4 dipole-dipole (scaled to zero) and
1-4 charge-dipole (e.g. 0.8) scaling factors seperately from the general 1-4
scaling. Can this also be done in AMBER by the scaldip flag? Or will I have to
modify the code? If so, could you please tell me in which subroutines these
factor appear?
Regards,
Diddo
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Received on Wed Feb 11 2009 - 01:18:58 PST
