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Feats: add DFT-D3(BJ) parameters for omegaB97M python unit tests #136: Pull request #173 synchronize by YutackPark
February 18, 2025 13:44 3m 53s SuyeonJu:main
SuyeonJu:main
February 18, 2025 13:44 3m 53s
Feats: add DFT-D3(BJ) parameters for omegaB97M python unit tests #135: Pull request #173 opened by SuyeonJu
February 17, 2025 02:54 3m 59s SuyeonJu:main
SuyeonJu:main
February 17, 2025 02:54 3m 59s
docs: remove MF from main + update citation info python unit tests #134: Pull request #169 synchronize by YutackPark
January 30, 2025 15:50 4m 1s YutackPark-patch-1
YutackPark-patch-1
January 30, 2025 15:50 4m 1s
docs: remove MF from main + update citation info python unit tests #133: Pull request #169 synchronize by YutackPark
January 30, 2025 15:47 4m 4s YutackPark-patch-1
YutackPark-patch-1
January 30, 2025 15:47 4m 4s
docs: remove MF from main + update citation info python unit tests #132: Pull request #169 opened by YutackPark
January 30, 2025 15:46 4m 7s YutackPark-patch-1
YutackPark-patch-1
January 30, 2025 15:46 4m 7s
Multimodal + cuEq + ... python unit tests #131: Pull request #71 synchronize by YutackPark
January 30, 2025 15:36 4m 10s multimodal
multimodal
January 30, 2025 15:36 4m 10s
Multimodal + cuEq + ... python unit tests #130: Pull request #71 synchronize by YutackPark
January 30, 2025 15:34 4m 3s multimodal
multimodal
January 30, 2025 15:34 4m 3s
fix: d3 calc ._lib init python unit tests #129: Pull request #168 opened by YutackPark
January 30, 2025 15:31 3m 22s dev
dev
January 30, 2025 15:31 3m 22s
change: compile D3 from setup.py to calculator.py python unit tests #128: Pull request #167 synchronize by YutackPark
January 30, 2025 15:07 3m 13s dev
dev
January 30, 2025 15:07 3m 13s
change: compile D3 from setup.py to calculator.py python unit tests #127: Pull request #167 synchronize by YutackPark
January 30, 2025 15:01 3m 5s dev
dev
January 30, 2025 15:01 3m 5s
change: compile D3 from setup.py to calculator.py python unit tests #126: Pull request #167 synchronize by YutackPark
January 30, 2025 14:57 3m 4s dev
dev
January 30, 2025 14:57 3m 4s
change: compile D3 from setup.py to calculator.py python unit tests #125: Pull request #167 opened by YutackPark
January 30, 2025 14:56 3m 16s dev
dev
January 30, 2025 14:56 3m 16s
Multimodal + cuEq + ... python unit tests #124: Pull request #71 synchronize by YutackPark
January 30, 2025 13:48 4m 14s multimodal
multimodal
January 30, 2025 13:48 4m 14s
Multimodal + cuEq + ... python unit tests #123: Pull request #71 synchronize by YutackPark
January 30, 2025 12:42 4m 5s multimodal
multimodal
January 30, 2025 12:42 4m 5s
docs: remove torch version cap python unit tests #122: Pull request #165 opened by YutackPark
January 29, 2025 14:46 3m 32s YutackPark-patch-1
YutackPark-patch-1
January 29, 2025 14:46 3m 32s
maintenence: torch >= 2.5.0, numpy >= 2.0.0 python unit tests #121: Pull request #164 synchronize by YutackPark
January 29, 2025 14:37 3m 21s dev
dev
January 29, 2025 14:37 3m 21s
maintenence: torch >= 2.5.0, numpy >= 2.0.0 python unit tests #120: Pull request #164 opened by YutackPark
January 29, 2025 14:32 3m 14s dev
dev
January 29, 2025 14:32 3m 14s
CUDA-accelerated ASE D3 calculator python unit tests #119: Pull request #152 synchronize by YutackPark
January 29, 2025 13:34 3m 17s dambi3613:with_D3_calculator
dambi3613:with_D3_calculator
January 29, 2025 13:34 3m 17s
CUDA-accelerated ASE D3 calculator python unit tests #118: Pull request #152 synchronize by YutackPark
January 29, 2025 13:32 3m 13s dambi3613:with_D3_calculator
dambi3613:with_D3_calculator
January 29, 2025 13:32 3m 13s
CUDA-accelerated ASE D3 calculator python unit tests #117: Pull request #152 synchronize by YutackPark
January 29, 2025 13:22 3m 8s dambi3613:with_D3_calculator
dambi3613:with_D3_calculator
January 29, 2025 13:22 3m 8s
fix: bugfix info dict sharing of structure_list python unit tests #116: Pull request #157 opened by YutackPark
January 9, 2025 07:15 3m 27s hotfix
hotfix
January 9, 2025 07:15 3m 27s
CUDA-accelerated ASE D3 calculator python unit tests #115: Pull request #152 synchronize by dambi3613
January 8, 2025 08:47 3m 15s dambi3613:with_D3_calculator
dambi3613:with_D3_calculator
January 8, 2025 08:47 3m 15s
allow scaling energy term in the loss python unit tests #114: Pull request #155 reopened by thangckt
January 8, 2025 06:39 3m 3s thangckt:scale_loss
thangckt:scale_loss
January 8, 2025 06:39 3m 3s
CUDA-accelerated ASE D3 calculator python unit tests #113: Pull request #152 synchronize by YutackPark
January 7, 2025 06:21 3m 9s dambi3613:with_D3_calculator
dambi3613:with_D3_calculator
January 7, 2025 06:21 3m 9s
[pre-commit.ci] pre-commit autoupdate python unit tests #112: Pull request #156 opened by pre-commit-ci bot
January 6, 2025 21:11 3m 16s pre-commit-ci-update-config
pre-commit-ci-update-config
January 6, 2025 21:11 3m 16s