[gmx-users] Re: mass-weighted analysis

wmiranda at estudiantes.fbio.uh.cu wmiranda at estudiantes.fbio.uh.cu
Thu Mar 22 21:58:52 CET 2012

Hello GROMACS users
I am Williams, the biochemistry student. If I want to calculate QH entropy
and my fit and analysis group are the same, the covariance matrix must be
mass weighted? Its a little bit confussing that part of the GROMACS manual

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