Re: [gmx-users] Membrane simulation with OPLS ff.

2013-09-27 Thread Oliver Beckstein
dbook.bioch.ox.ac.uk/package/ select OPLS and Gromacs. Specifically, POPC is http://lipidbook.bioch.ox.ac.uk/package/show/id/52.html Oliver -- Oliver Beckstein * oliver.beckst...@asu.edu http://becksteinlab.physics.asu.edu/ Arizona State University Department of Physics Tempe, AZ 85287-1504 USA

Re: [gmx-users] fraction of native contacts calculation

2012-11-01 Thread Oliver Beckstein
ussion — people there are more than happy to help.) Best wishes, Oliver -- Oliver Beckstein * oliver.beckst...@asu.edu http://becksteinlab.physics.asu.edu/ Arizona State University Department of Physics Tempe, AZ 85287-1504 USA Office: PSF 348 Phone: +1 (480) 727-9765 FAX: +1 (480) 965-4669

Re: [gmx-users] Obtain the flux of water

2012-01-02 Thread Oliver Beckstein
ction). Feel free to report problems and fixes/patches through the Issue tracker https://github.com/orbeckst/g_count/issues . Cheers, Oliver -- Oliver Beckstein * oliver.beckst...@asu.edu http://physics.asu.edu/home/people/faculty/oliver-beckstein Arizona State University Department of Physi

[gmx-users] force field parameters for lipids on lipidbook.bioch.ox.ac.uk

2010-09-18 Thread Oliver Beckstein
http://lipidbook.bioch.ox.ac.uk/package/about.html#contact or file a problem with the Lipidbook Issue Tracker http://lipidbook.bioch.ox.ac.uk/trac/ . Many thanks for your time! Oliver Beckstein Jan Domanski Phill Stansfeld Mark Sansom [1] J. Domański, P. Stansfeld, M.S.P. Sansom, and O. Beck