VMD-L Mailing List
From: Shah, Tanooj (shaht2_at_rpi.edu)
Date: Mon Jul 03 2023 - 17:09:42 CDT
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Hello,
I wanted to ask if anyone has used Drude oscillators to simulate OH- ions with the polarizable version of CHARMM. As far as I can tell the only polarizable ions supported for the SWM4NDP water model are Li+, Na+, K+, Cs+, Rb+, Cl-, F-, Br- and I-.
Best,
Tanooj
-----------------------
Tanooj Shah
Graduate Student
Department of Materials Science and Engineering
Rensselaer Polytechnic Institute
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