biod.pnpi.spb.ru / alexxy / gromacs.git / commit
? search:
summary | shortlog | log | commit | commitdiff | tree
(parent: c0c733b) | patch
Re-implemented the fluctuation analysis, based on Enthalpy, Volume,
authorDavid van der Spoel <spoel@xray.bmc.uu.se>
Mon, 23 May 2011 20:11:15 +0000 (22:11 +0200)
committerDavid van der Spoel <spoel@xray.bmc.uu.se>
Mon, 23 May 2011 20:11:15 +0000 (22:11 +0200)
commiteb8394ac376873370b18caea12e5022ffa5214b7
tree395b1e0977cfb7e4ad19651413b38c194dbed127tree | snapshot
parentc0c733bd85c50a5766196923df0149c750627a78commit | diff
Re-implemented the fluctuation analysis, based on Enthalpy, Volume,
Temperature and/or Total Energy. Now correct as well.
src/tools/gmx_energy.c diff | blob | history
Local GROMACS mirror with custom stuff