[gmx-users] soft core potential
Ilya Chorny
ichorny at maxwell.compbio.ucsf.edu
Thu Oct 2 19:12:01 CEST 2003
Hello
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
potential.
Thanks
Ilya
--
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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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