From: Rudra Banerjee (bnrj.rudra_at_yahoo.com)
Date: Tue Aug 26 2008 - 09:50:31 CDT
i have a rather silly question.
given that vanderwalls' potential is pair potential,how can we define the 'cutoff' and 'switchdist' key in .conf file, which will apply same value of cutoff for all atom pair? my feeling is it implies all type of atom combination will have same cut-off. isnt it physically arguable?
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