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Gromacs for Mac OS X and Linux 4.6.5 freeware
... 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. ...
| Author | Gromacs.org |
| Released | 2013-12-02 |
| Filesize | 10.00 MB |
| Downloads | 1066 |
| OS | Linux, Mac OS X |
| Installation | Instal And Uninstall |
| Keywords | perform, molecular, biochemical, molecules, biological |
| Users' rating (18 rating) |
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| Our rating |
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Gromacs for Mac OS X and Linux Free Download - we do not host any Gromacs for Mac OS X and Linux torrent files or links of Gromacs for Mac OS X and Linux on rapidshare.com, depositfiles.com, megaupload.com etc. All Gromacs for Mac OS X and Linux download links are direct Gromacs for Mac OS X and Linux download from publisher site or their selected mirrors.
| 4.6.5 | Dec 2, 2013 | New Release | * Fixed GPU-load balancing and GPU-sharing bugs introduced in a bug fix in 4.6.4 #1385 * Fixed possible Verlet-scheme memory issue with SIMD on 32-bit builds * Fixed variable name in documentation * Fixed harmless bug with useless sorting of bonded interactions in free-energy calculations #1387 |
| 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. |
