History Graph
History Graph
Commit | Author | Details | Committed | |||
---|---|---|---|---|---|---|
2a026c9ad8ea | dstelter92 | revised temper_grem example, better file management | Nov 17 2016 | |||
4a3091f844ef | dstelter92 | modified temper_grem example with more exchanges | Nov 17 2016 | |||
5ac2d9532ed6 | dstelter92 | Re-run example with debug off | Nov 17 2016 | |||
19ac9d295995 | dstelter92 | turned off dev mode by default in temper_grem | Nov 17 2016 | |||
9f313aac75f9 | dstelter92 | shorter example | Nov 17 2016 | |||
0102c5dadc3b | dstelter92 | file cleanup | Nov 17 2016 | |||
07e46b797a29 | dstelter92 | added internal tempering in grem with example | Nov 17 2016 | |||
82364d10e335 | Axel Kohlmeyer | Merge branch 'grem-feature' of https://github.com/dstelter92/lammps into grem… | Nov 16 2016 | |||
683f514fac6a | Axel Kohlmeyer | simplify multi-replica run by passing per-replica parameters as variables on… | Nov 16 2016 | |||
1c68e42ecc02 | Axel Kohlmeyer | fix_modify is not longer needed | Nov 14 2016 | |||
5f94b318062b | Axel Kohlmeyer | add multi-replica example for gREM | Nov 14 2016 | |||
14c7cf419733 | Axel Kohlmeyer | retrieve target temperature and pressure from fix npt. add sanity checks. | Nov 14 2016 | |||
26870f223d66 | Axel Kohlmeyer | add example for gREM | Nov 14 2016 | |||
b27179bbef55 | Axel Kohlmeyer | restore bugfixes and updates that were lost. flag time dependet. correct use of… | Sep 21 2016 | |||
b9b044e180df | Steve Plimpton | new fix ti/spring command, remove fix ti/rs | Sep 20 2016 | |||
7512821dd62a | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14628 f3b2605a-c512-4ea7… | Feb 15 2016 | |||
507bde5b5a92 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14627 f3b2605a-c512-4ea7… | Feb 15 2016 | |||
ed9e16202518 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@14626 f3b2605a-c512-4ea7… | Feb 15 2016 | |||
bf8b5e4d630a | stamoor | Fixing broken basal example | Sep 26 2014 | |||
1f0a6ae006ad | stamoor | Fixed broken basal example | Apr 14 2014 | |||
90a2bccf8379 | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10956 f3b2605a-c512-4ea7… | Nov 4 2013 | |||
b12b9fced98e | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@10409 f3b2605a-c512-4ea7… | Jul 26 2013 | |||
fbc3f58a054a | sjplimp | git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@9027 f3b2605a-c512-4ea7… | Oct 27 2012 |
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