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Enabled removing leading comments from json DB (#83)
Auto build HIPPYNN docs and publish on GitHub Pages #46: Commit 9c221a0 pushed by bnebgen-LANL
July 17, 2024 21:24 1m 46s development
July 17, 2024 21:24 1m 46s
minor changes to MD code & its documentation (#81)
Auto build HIPPYNN docs and publish on GitHub Pages #45: Commit 00e0094 pushed by shinkle-lanl
June 24, 2024 19:25 1m 41s development
June 24, 2024 19:25 1m 41s
fix imports issue causing error when building docs (#80)
Auto build HIPPYNN docs and publish on GitHub Pages #44: Commit 7e6614e pushed by shinkle-lanl
June 24, 2024 19:12 1m 30s development
June 24, 2024 19:12 1m 30s
Auto build HIPPYNN docs and publish on GitHub Pages
Auto build HIPPYNN docs and publish on GitHub Pages #43: Manually run by shinkle-lanl
June 24, 2024 18:41 1m 24s development
June 24, 2024 18:41 1m 24s
update docstring format in molecular_dynamics/md.py for compatibility…
Auto build HIPPYNN docs and publish on GitHub Pages #42: Commit e1c2ba9 pushed by shinkle-lanl
June 24, 2024 18:01 1m 26s development
June 24, 2024 18:01 1m 26s
06102024 add optimizer/ with batch FIRE algorithm implemented with py…
Auto build HIPPYNN docs and publish on GitHub Pages #41: Commit 3fc7a31 pushed by lubbersnick
June 10, 2024 20:17 1m 40s development
June 10, 2024 20:17 1m 40s
add documentation for new md code (#77)
Auto build HIPPYNN docs and publish on GitHub Pages #40: Commit 3f0c605 pushed by shinkle-lanl
June 6, 2024 21:52 1m 45s development
June 6, 2024 21:52 1m 45s
add documentation for new md code (#76)
Auto build HIPPYNN docs and publish on GitHub Pages #39: Commit 41ad80b pushed by shinkle-lanl
June 6, 2024 21:21 1m 42s development
June 6, 2024 21:21 1m 42s
update graph exploration example notebook
Auto build HIPPYNN docs and publish on GitHub Pages #38: Commit 076f42c pushed by lubbersnick
June 5, 2024 19:51 1m 40s development
June 5, 2024 19:51 1m 40s
Add custom MD driver and improve pairfinder memory performance (#71)
Auto build HIPPYNN docs and publish on GitHub Pages #37: Commit 7e8246b pushed by lubbersnick
June 5, 2024 18:47 1m 29s development
June 5, 2024 18:47 1m 29s
fix coordinate wrapping issue in KDTree paifinders (#73)
Auto build HIPPYNN docs and publish on GitHub Pages #36: Commit 0796fe4 pushed by shinkle-lanl
June 4, 2024 21:49 1m 37s development
June 4, 2024 21:49 1m 37s
Added write_h5 function (#70)
Auto build HIPPYNN docs and publish on GitHub Pages #35: Commit 8d5fd8a pushed by bnebgen-LANL
April 30, 2024 16:41 1m 46s development
April 30, 2024 16:41 1m 46s
update new notebook
Auto build HIPPYNN docs and publish on GitHub Pages #34: Commit cefc093 pushed by lubbersnick
April 25, 2024 23:03 1m 35s development
April 25, 2024 23:03 1m 35s
Add notebook for graph visualization
Auto build HIPPYNN docs and publish on GitHub Pages #33: Commit 036b153 pushed by lubbersnick
April 24, 2024 22:57 1m 39s development
April 24, 2024 22:57 1m 39s
Fix for bug introduced for database loading
Auto build HIPPYNN docs and publish on GitHub Pages #32: Commit 2f0671f pushed by lubbersnick
April 16, 2024 21:54 1m 34s development
April 16, 2024 21:54 1m 34s
Ensemble creation feature (#68)
Auto build HIPPYNN docs and publish on GitHub Pages #31: Commit 7d3e0f3 pushed by lubbersnick
April 13, 2024 07:16 1m 41s development
April 13, 2024 07:16 1m 41s
Deploy versioneer 0.29 for python 3.12 compatibility (#64)
Auto build HIPPYNN docs and publish on GitHub Pages #30: Commit 604a93c pushed by lubbersnick
April 10, 2024 22:20 1m 56s development
April 10, 2024 22:20 1m 56s
energy initialization (#66)
Auto build HIPPYNN docs and publish on GitHub Pages #29: Commit 4d7add5 pushed by lubbersnick
April 10, 2024 21:46 1m 33s development
April 10, 2024 21:46 1m 33s
remove need for backwards compatibility operation in feature nodes (#65)
Auto build HIPPYNN docs and publish on GitHub Pages #28: Commit ba363b3 pushed by lubbersnick
April 9, 2024 17:51 2m 55s development
April 9, 2024 17:51 2m 55s
Updated Cusp Regularization (#59)
Auto build HIPPYNN docs and publish on GitHub Pages #27: Commit e576555 pushed by lubbersnick
April 9, 2024 16:18 1m 49s development
April 9, 2024 16:18 1m 49s
add weights for loss functions (#63)
Auto build HIPPYNN docs and publish on GitHub Pages #26: Commit e5ad4e2 pushed by lubbersnick
April 8, 2024 23:29 1m 38s development
April 8, 2024 23:29 1m 38s
fix typo in example code
Auto build HIPPYNN docs and publish on GitHub Pages #25: Commit e84f93c pushed by lubbersnick
April 5, 2024 22:39 1m 37s development
April 5, 2024 22:39 1m 37s
add features and example for using them (#62)
Auto build HIPPYNN docs and publish on GitHub Pages #24: Commit 3ddc0c6 pushed by lubbersnick
April 5, 2024 22:29 1m 37s development
April 5, 2024 22:29 1m 37s
Add timeplot scaling setting (#58)
Auto build HIPPYNN docs and publish on GitHub Pages #23: Commit 02a0278 pushed by lubbersnick
January 30, 2024 21:05 1m 25s development
January 30, 2024 21:05 1m 25s
Update version
Auto build HIPPYNN docs and publish on GitHub Pages #22: Commit b4984e1 pushed by lubbersnick
January 29, 2024 21:56 1m 53s development
January 29, 2024 21:56 1m 53s