AMBER Archive (2002)

Subject: How to set the dielctric constant equals 1, when running MD simulations in real solvent water?

From: Ling Zhang (lz267_at_nyu.edu)
Date: Thu Jun 13 2002 - 15:54:53 CDT

Dear All,

When running MD simulation in a real water solvent enviroment using AMBER6 package, does that IGB = 0 means the dielectric constant equals 1.0 as default? Thanks for your help.

Best,
Ling