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Last Change |
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3502 (15 years ago) by gezelter: Adding Madelung energy sample directory with explanatory notes |
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3513 (15 years ago) by gezelter: Adding one RNEMD sample |
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3485 (15 years ago) by chuckv: Adding samples for SMIPD. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3444 (15 years ago) by cli2: Fixes for Torsions and Inversions, Amber is mostly working now. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3059 (17 years ago) by gezelter: more openbabel updates, also changing velocitizer to thermalizer to avoid a filename collision on case-insensitve file systems |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3450 (15 years ago) by chuckv: Added large quantities of code for convex hull and constant pressure langevin dynamics. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3286 (16 years ago) by cpuglis: Many fixes for Charmm-type torsions. |
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3146 (17 years ago) by chuckv: Fixed Makefile problems with the samples and added several missing makefiles. |
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3472 (15 years ago) by gezelter: doing zeolite sample |