[gmx-users] comparison of covariance analysis and normal mode analysis for entropy calculations
Hari Shankar M
hari711 at yahoo.com
Tue Apr 19 21:02:51 CEST 2011
I was wondering if anyone compared the entropy estimates obtained from covariance analysis and normal mode analysis for a simple one-well case, using the GROMACS 4.5 version. If so, how well do these match?
Postdoctoral Scholar (Gilson Group)
University of California, San Diego
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