Added proper fluctuation output to g_energy. Now we finally get correct
commit0380f4915bad3788885a9267dcfdd88eb7250b98
authorDavid van der Spoel <spoel@anfinsen.bmc.uu.se>
Thu, 21 Jan 2010 13:10:46 +0000 (21 14:10 +0100)
committerDavid van der Spoel <spoel@anfinsen.bmc.uu.se>
Thu, 21 Jan 2010 13:10:46 +0000 (21 14:10 +0100)
tree4f42748e8039e206f68701e4926360fda9046aba
parent0b5cbc738ed98ada9dab41a9a02166a2d948c59b
Added proper fluctuation output to g_energy. Now we finally get correct
heat capacities and other properties like the thermal expansion coefficient.
Added some functionality to statistics library.
Added one ref to the copyrite database.
src/gmxlib/copyrite.c
src/gmxlib/replace.c
src/gmxlib/statistics/gmx_statistics.c
src/tools/gmx_energy.c