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Use uv in CI Test #439: Commit 93aee72 pushed by vsimkus
4m 56s alchemi-knn-d3-torchsim-refactor
alchemi-knn-d3-torchsim-refactor
4m 56s
Alchemiops KNN+D3, TorchSim, Refactor Test #438: Pull request #143 synchronize by vsimkus
1m 3s alchemi-knn-d3-torchsim-refactor
alchemi-knn-d3-torchsim-refactor
1m 3s
Use uv in CI Test #437: Commit 1f8402a pushed by vsimkus
1m 7s alchemi-knn-d3-torchsim-refactor
alchemi-knn-d3-torchsim-refactor
1m 7s
Alchemiops KNN+D3, TorchSim, Refactor Test #436: Pull request #143 opened by vsimkus
42s alchemi-knn-d3-torchsim-refactor
alchemi-knn-d3-torchsim-refactor
42s
TorchSim and D3 examples, bug fixes Test #435: Commit 1b39381 pushed by vsimkus
45s alchemi-knn-d3-torchsim-refactor
alchemi-knn-d3-torchsim-refactor
45s
Update code Test #434: Commit d978d56 pushed by vsimkus
41s 02-02-switch_to_uv
02-02-switch_to_uv
41s
Switch to uv Test #433: Commit cf00504 pushed by vsimkus
15m 4s 02-02-switch_to_uv
02-02-switch_to_uv
15m 4s
Make wandb optional in finetune.py (#140) Test #432: Commit 6ad92b4 pushed by vsimkus
5m 43s main
main
5m 43s
Make wandb optional in finetune.py script Test #431: Pull request #140 synchronize by vsimkus
5m 26s make-wandb-optional
make-wandb-optional
5m 26s
Make wandb optional in finetune.py Test #430: Commit 0aef934 pushed by vsimkus
5m 22s make-wandb-optional
make-wandb-optional
5m 22s
more info in Error message ChargeSpinConditioner (#141) Test #429: Commit 5075166 pushed by vsimkus
5m 24s main
main
5m 24s
More info in Error message ChargeSpinConditioner Test #428: Pull request #141 synchronize by vsimkus
5m 40s thomasloux:add-info-failing-spin-charge-conditioner
thomasloux:add-info-failing-spin-charge-conditioner
5m 40s
Make wandb optional in finetune.py script Test #426: Pull request #140 opened by vsimkus
5m 25s make-wandb-optional
make-wandb-optional
5m 25s
Make wandb optional in finetune.py Test #425: Commit 6a65c09 pushed by vsimkus
5m 30s make-wandb-optional
make-wandb-optional
5m 30s
Enhanced finetune.py with custom loss weights and reference energies … Test #424: Commit 69277a6 pushed by timduignan
5m 56s main
main
5m 56s
Enhanced finetune.py with custom loss weights and reference energies Test #423: Pull request #133 synchronize by timduignan
6m 0s timduignan:custom-loss-weights-and-reference-energies-clean
timduignan:custom-loss-weights-and-reference-energies-clean
6m 0s
Make wandb optional in finetune.py Test #422: Commit 175ea73 pushed by vsimkus
8m 44s make-wandb-optional
make-wandb-optional
8m 44s
Enhanced finetune.py with custom loss weights and reference energies Test #421: Pull request #133 synchronize by timduignan
5m 29s timduignan:custom-loss-weights-and-reference-energies-clean
timduignan:custom-loss-weights-and-reference-energies-clean
5m 29s
Enhanced finetune.py with custom loss weights and reference energies Test #420: Pull request #133 synchronize by timduignan
5m 43s timduignan:custom-loss-weights-and-reference-energies-clean
timduignan:custom-loss-weights-and-reference-energies-clean
5m 43s
Highlight in MODELS.md that OrbMol models are for non-periodic system… Test #419: Commit 6ac855d pushed by timduignan
6m 13s main
main
6m 13s
Enhanced finetune.py with custom loss weights and reference energies Test #418: Pull request #133 synchronize by timduignan
5m 29s timduignan:custom-loss-weights-and-reference-energies-clean
timduignan:custom-loss-weights-and-reference-energies-clean
5m 29s
Enhanced finetune.py with custom loss weights and reference energies Test #417: Pull request #133 synchronize by timduignan
5m 50s timduignan:custom-loss-weights-and-reference-energies-clean
timduignan:custom-loss-weights-and-reference-energies-clean
5m 50s
Add total charge and spin to property definitions Test #416: Pull request #134 synchronize by vsimkus
5m 51s add-total-charge-and-spin-to-property-definitions
add-total-charge-and-spin-to-property-definitions
5m 51s
Add total charge and spin to property definitions Test #415: Commit 2791723 pushed by vsimkus
6m 10s add-total-charge-and-spin-to-property-definitions
add-total-charge-and-spin-to-property-definitions
6m 10s
Add total charge and spin to property definitions Test #414: Pull request #134 opened by vsimkus
8m 52s add-total-charge-and-spin-to-property-definitions
add-total-charge-and-spin-to-property-definitions
8m 52s