Hello everyone:
I have a simulation system containing the arsenous acid (H3AsO3) molecules in the aqueous solution.
The problem I am facing is that there are no force filed parameters involving Arsenic (As) in AMBER.
How to parameterize this inorganic acid from the scratch?
Any suggestion and experience would be greatly appreciated!
Best,
Zhicheng
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Received on Thu Jul 19 2018 - 21:30:02 PDT
