Re: [Apbs-users] asking about APBS
Biomolecular electrostatics software
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From: Nathan B. <ba...@bi...> - 2009-01-13 00:55:35
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Hi Alexander -- Have you tried the "calcenergy comps" keyword? Is the resulting "Mobile charge energy" what you're looking for? Thanks, Nathan On Fri, Jan 9, 2009 at 12:12 PM, Alexander Silalahi <as...@fs...> wrote: > Dear Dr.Baker, > > I am using the APBS for calculating the Electrostatic solvation Free > Energy, and i need to decompose the energy term into osmotic pressure and > electrostatic stress term. How do i do this with APBS? > > Regards, > ALex > -- Associate Professor, Dept. of Biochemistry and Molecular Biophysics Center for Computational Biology, Washington University in St. Louis Web: http://cholla.wustl.edu/ |