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Feature/cleanup Tests #47: Pull request #61 opened by ferchault
5m 10s feature/cleanup
feature/cleanup
5m 10s
Add orbital-weighted learning with --owl Tests #46: Pull request #60 synchronize by Copilot AI
4m 1s feature/owl
feature/owl
4m 1s
Add orbital-weighted learning with --owl Tests #45: Pull request #60 synchronize by ferchault
3m 36s feature/owl
feature/owl
3m 36s
Add orbital-weighted learning with --owl Tests #44: Pull request #60 synchronize by ferchault
4m 4s feature/owl
feature/owl
4m 4s
Add orbital-weighted learning with --owl Tests #43: Pull request #60 opened by GaKl077691
5m 14s feature/owl
feature/owl
5m 14s
Attach charge and spin to prediction molecules Tests #42: Pull request #59 opened by GaKl077691
5m 23s fix/prediction-charges
fix/prediction-charges
5m 23s
Add charge and spin detrending, select terms with --detrending Tests #41: Pull request #57 synchronize by GaKl077691
4m 49s feature/detrending
feature/detrending
4m 49s
Add MACE-OFF and MACE-OMol foundation model representations Tests #40: Pull request #58 opened by GaKl077691
5m 6s feature/mace-foundation-models
feature/mace-foundation-models
5m 6s
Add charge and spin detrending, select terms with --detrending Tests #39: Pull request #57 opened by GaKl077691
5m 4s feature/detrending
feature/detrending
5m 4s
Read charge and spin multiplicity from datasets Tests #38: Pull request #56 opened by GaKl077691
4m 50s feature/dataset-charges
feature/dataset-charges
4m 50s
Add nc krr tutorial Tests #37: Pull request #54 opened by uk071008
5m 10s add-nc-krr-tutorial
add-nc-krr-tutorial
5m 10s
Predict on fixed set Tests #36: Pull request #53 synchronize by ferchault
4m 0s feature/pred
feature/pred
4m 0s
Predict on fixed set Tests #35: Pull request #53 opened by ferchault
5m 41s feature/pred
feature/pred
5m 41s
CABS Derivatives and Tests Tests #34: Pull request #52 synchronize by ferchault
4m 44s feature/cabs
feature/cabs
4m 44s
CABS Derivatives and Tests Tests #33: Pull request #52 opened by ferchault
4m 51s feature/cabs
feature/cabs
4m 51s
Version bump Tests #32: Pull request #47 opened by ferchault
12m 2s release
release
12m 2s
Skip infeasible Kmat, faster Chebychev Tests #31: Pull request #46 opened by ferchault
10m 29s feature/skip
feature/skip
10m 29s
Faster inference, better docs Tests #30: Pull request #44 opened by ferchault
11m 16s feature/clean
feature/clean
11m 16s
Memory saving local kernels Tests #29: Pull request #43 opened by ferchault
10m 7s feature/memory
feature/memory
10m 7s
switched the order of shuffles and lambdas loops Tests #28: Pull request #42 opened by GaKl077691
9m 34s feature/shuffle_logic
feature/shuffle_logic
9m 34s
added eigenschur Tests #27: Pull request #41 opened by GaKl077691
10m 14s feature/eigenschur
feature/eigenschur
10m 14s
Out of core processing for large datasets Tests #26: Pull request #38 synchronize by ferchault
7m 52s feature/memory
feature/memory
7m 52s
Out of core processing for large datasets Tests #25: Pull request #38 opened by ferchault
10m 39s feature/memory
feature/memory
10m 39s
Split optimizer Tests #24: Pull request #34 opened by ferchault
10m 3s feature/cabsopt
feature/cabsopt
10m 3s
Pairwise detrending, closes #31 Tests #23: Pull request #32 opened by ferchault
9m 28s feature/detrend-pairs
feature/detrend-pairs
9m 28s