AMBER Archive (2006)

Subject: AMBER: saltconc for explicit solvent calculation.

From: a a (patd_2_at_hotmail.com)
Date: Thu Nov 09 2006 - 11:51:36 CST


Dear All,

Could you mind to let me know if I can still use the "saltconc=1 M" command
in the MD calculations? When I am doing explicit solvent calculations?
while it should be possible for implicit solvent calculations. If I should
not use "saltconc" commands to define the concentration of salt for implicit
solvent calculations, what should i do to account for salt concentration
effects?

Best regards,

Annie

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