Gromacs for Mac OS X and Linux 4.5.5 freeware    

Author Gromacs.org OS Linux, Mac OS X Date Released September 20, 2011 Downloads 77 Filesize 9.92 MB Keywords perform, molecular, biochemical, molecules, biological Your Rating   - click to rate - you will be first!

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It is primarily designed for biochemical molecules like proteins, lipids and nucleic acids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non-biological systems, e.g. polymers. ...

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Version	Date Released	Status	Release Notes
4.5.5	Sep 20, 2011	New Release	* Improved pdb2gmx -chainsep option and reintroduced the -merge option. * Fixed mdrun file appending truncating files to 0 bytes when continuation runs stopped before writing new output. * Fixed COM pulling with multiple constraints checking the convergence of one constraint instead of all. * Fixed some dihedrals in sugars in Gromos53a5/6 working on the wrong atoms. * AmberGS force field is now based on Amber94 instead of Amber96. * Moved hydrogens in Charmm27 protein termini to separate charge groups and added ACE and CT3 residue types. * Many small fixes which avoid termination with fatal errors or crashes in mdrun and tools. * Many small updates to the manual pages of programs.