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Add batched prediction to molecular dynamics (#134) Auto build HIPPYNN docs and publish on GitHub Pages #83: Commit 372a890 pushed by lubbersnick
March 4, 2025 17:33 1m 18s development
development
March 4, 2025 17:33 1m 18s
new Langevin MD integrator implemented (#129) Auto build HIPPYNN docs and publish on GitHub Pages #82: Commit c727bc7 pushed by shinkle-lanl
February 20, 2025 17:41 1m 16s development
development
February 20, 2025 17:41 1m 16s
Kdtree fix (#130) Auto build HIPPYNN docs and publish on GitHub Pages #81: Commit 3192c15 pushed by shinkle-lanl
February 20, 2025 17:36 1m 28s development
development
February 20, 2025 17:36 1m 28s
add species indexing node (#128) Auto build HIPPYNN docs and publish on GitHub Pages #80: Commit 3652beb pushed by shinkle-lanl
February 20, 2025 17:31 1m 20s development
development
February 20, 2025 17:31 1m 20s
Add atomization-consistent training and other features/fixes (#123) Auto build HIPPYNN docs and publish on GitHub Pages #79: Commit 78059c7 pushed by lubbersnick
January 22, 2025 18:42 1m 33s development
development
January 22, 2025 18:42 1m 33s
Update test_speed_env.py (#120) Auto build HIPPYNN docs and publish on GitHub Pages #78: Commit 6dd3a91 pushed by lubbersnick
October 31, 2024 18:50 1m 43s development
development
October 31, 2024 18:50 1m 43s
improve ensembling robustness and documentation (#119) Auto build HIPPYNN docs and publish on GitHub Pages #77: Commit 480281f pushed by lubbersnick
October 30, 2024 21:42 1m 22s development
development
October 30, 2024 21:42 1m 22s
Fix some issues with the speed tests in custom kernels (#117) Auto build HIPPYNN docs and publish on GitHub Pages #76: Commit a0b5ca7 pushed by lubbersnick
October 29, 2024 00:08 1m 16s development
development
October 29, 2024 00:08 1m 16s
fix StressForceNode (#110) Auto build HIPPYNN docs and publish on GitHub Pages #75: Commit 957de00 pushed by shinkle-lanl
October 24, 2024 18:49 1m 19s development
development
October 24, 2024 18:49 1m 19s
add missing import (#116) Auto build HIPPYNN docs and publish on GitHub Pages #74: Commit 862ed0f pushed by shinkle-lanl
October 22, 2024 17:55 1m 35s development
development
October 22, 2024 17:55 1m 35s
change method of custom MD driver for handling units (#115) Auto build HIPPYNN docs and publish on GitHub Pages #73: Commit 6c6d9d1 pushed by shinkle-lanl
October 22, 2024 17:49 1m 19s development
development
October 22, 2024 17:49 1m 19s
new example (#108) Auto build HIPPYNN docs and publish on GitHub Pages #72: Commit 497cf15 pushed by lubbersnick
October 21, 2024 16:01 1m 22s development
development
October 21, 2024 16:01 1m 22s
clarify language on units for custom MD algorithms, remove default un… Auto build HIPPYNN docs and publish on GitHub Pages #71: Commit 4522014 pushed by shinkle-lanl
October 18, 2024 20:54 1m 26s development
development
October 18, 2024 20:54 1m 26s
fix bug with saving batched MD results (#109) Auto build HIPPYNN docs and publish on GitHub Pages #70: Commit 10bded4 pushed by shinkle-lanl
October 17, 2024 19:04 1m 26s development
development
October 17, 2024 19:04 1m 26s
fix doc page Auto build HIPPYNN docs and publish on GitHub Pages #69: Commit c330ddf pushed by lubbersnick
October 9, 2024 18:49 1m 25s development
development
October 9, 2024 18:49 1m 25s
Custom kernel improvements (#107) Auto build HIPPYNN docs and publish on GitHub Pages #68: Commit 36b7350 pushed by lubbersnick
September 27, 2024 22:28 1m 21s development
development
September 27, 2024 22:28 1m 21s
add back hyperopt example to main index Auto build HIPPYNN docs and publish on GitHub Pages #67: Commit c1c084c pushed by lubbersnick
September 20, 2024 21:22 1m 26s development
development
September 20, 2024 21:22 1m 26s
Fix documentation workflow (#106) Auto build HIPPYNN docs and publish on GitHub Pages #66: Commit 4d0f534 pushed by lubbersnick
September 20, 2024 21:15 1m 28s development
development
September 20, 2024 21:15 1m 28s
Many improvements to documentation, some workflow improvements (#105) Auto build HIPPYNN docs and publish on GitHub Pages #65: Commit ad3680d pushed by lubbersnick
September 20, 2024 21:07 1m 3s development
development
September 20, 2024 21:07 1m 3s
Add the documentation and examples for hyperparameter tuning (#103) Auto build HIPPYNN docs and publish on GitHub Pages #64: Commit ddf5ca6 pushed by lubbersnick
September 20, 2024 20:29 1m 41s development
development
September 20, 2024 20:29 1m 41s
Bugfixes to custom kernels, doc updates, changelog updates (#102) Auto build HIPPYNN docs and publish on GitHub Pages #63: Commit 144c160 pushed by lubbersnick
September 13, 2024 20:24 1m 26s development
development
September 13, 2024 20:24 1m 26s
Many documentation updates, small tweaks to database interface. (#100) Auto build HIPPYNN docs and publish on GitHub Pages #62: Commit 110b831 pushed by lubbersnick
September 9, 2024 23:48 1m 59s development
development
September 9, 2024 23:48 1m 59s
change setup to include pyproject.toml file (#97) Auto build HIPPYNN docs and publish on GitHub Pages #61: Commit be79f3a pushed by lubbersnick
September 9, 2024 17:13 1m 47s development
development
September 9, 2024 17:13 1m 47s
Add coarse-graining example (#98) Auto build HIPPYNN docs and publish on GitHub Pages #60: Commit 10a9055 pushed by lubbersnick
September 9, 2024 17:05 1m 36s development
development
September 9, 2024 17:05 1m 36s
Add pytorch lightning trainer (#99) Auto build HIPPYNN docs and publish on GitHub Pages #59: Commit 0004728 pushed by lubbersnick
September 7, 2024 00:51 1m 35s development
development
September 7, 2024 00:51 1m 35s