File
|
Last Change |
|---|---|
 ../
|
|
utils/
|
986 (20 years ago) by gezelter: Changes to BASS reader to use Euler angles for orientation instead of unit vectors required changes in MoLocator |
|
third-party/
|
960 (20 years ago) by gezelter: Added a bunch of dummy targets so make won't complain |
|
staticProps/
|
1043 (20 years ago) by mmeineke: started a bug fix on the massive memory overusage by OOPSE |
|
src/
|
1031 (20 years ago) by tim: Add some lines into global.cpp to make it work with energy minimization |
|
scripts/
|
622 (20 years ago) by mmeineke: added a quick wipe-and-update script for quick rebuilds on BoB |
|
samples/
|
1035 (20 years ago) by tim: Single version of energy minimization for argon is working, need to add constraint |
|
libmdtools/
|
1046 (20 years ago) by tim: single version of energy minimization is working. |
|
libBASS/
|
1035 (20 years ago) by tim: Single version of energy minimization for argon is working, need to add constraint |
|
forceFields/
|
999 (20 years ago) by chrisfen: Substantial changes. OOPSE now has a working WATER.cpp forcefield and parser. This involved changes to WATER.cpp and ForceFields amoung other files. One important note: a hardwiring of LJ_rcut was made in calc_LJ_FF.F90. This will be removed on the next commit... |
|
ac-tools/
|
948 (20 years ago) by gezelter: Changes for altivec |
configure
|
949 (20 years ago) by chuckv: Fixes for Dumps |
|
README
|
444 (21 years ago) by gezelter: Changed Readme, added some files |
|
NEWS
|
378 (21 years ago) by mmeineke: This commit was generated by cvs2svn to compensate for changes in r377, which included commits to RCS files with non-trunk default branches. |
|
Makefile.in
|
826 (20 years ago) by gezelter: Stuff for MOD support in other compilers |
|
LICENSE
|
384 (21 years ago) by gezelter: Added license file |
|
ChangeLog
|
1046 (20 years ago) by tim: single version of energy minimization is working. |
|
AUTHORS
|
378 (21 years ago) by mmeineke: This commit was generated by cvs2svn to compensate for changes in r377, which included commits to RCS files with non-trunk default branches. |