[gmx-users] Ion Parametrization in OPLS-AA forcefield

srinivas ramachandran tr.srinivas at gmail.com
Thu Apr 24 21:08:14 CEST 2008


Dear All,

I require the papers in which the original parameters (in ions.itp) for ions
in OPLSAA force field was published. Also I would like to if there are any
studies in which these ion parameters were benchmarked with experimental
values.

Thanks a lot.

Regards
Srinivas

-- 
Srinivas Ramachandran
Graduate Student
Molecular and Cellular Biophysics Program
Department of Biochemistry and Biophysics
University of North Carolina at Chapel Hill
USA
www.unc.edu/~ramachan
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