[gmx-users] soft core potential

Ilya Chorny ichorny at maxwell.compbio.ucsf.edu
Thu Oct 2 19:12:01 CEST 2003


In the manual it says that by default sc_sigma = .3 nm.
What C6 value does this correspond to. More specifically I have C6 set
to 0.0. What will gromacs use as the C6 value in the soft core


Ilya Chorny Ph.D.         Department of Pharmaceutical Chemistry
Postdoctoral Researcher   University of California-San Francisco
phone: (408)-887-8496     Genentech Hall 600 16th St Box 2240
fax: (415)502-1411        San Francisco, Ca, 94107
            email: ichorny at maxwell.ucsf.edu

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