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Add preliminary unit test for scores benchmarking. CI #32: Pull request #4 synchronize by amrismil
36m 47s unit-test
unit-test
36m 47s
Update environment.yaml CI #31: Commit cad03d8 pushed by amrismil
22m 38s unit-test
unit-test
22m 38s
Add preliminary unit test for scores benchmarking. CI #30: Pull request #4 synchronize by amrismil
32m 28s unit-test
unit-test
32m 28s
Update pyproject.toml to include polars. CI #29: Commit 58af13f pushed by amrismil
16m 11s unit-test
unit-test
16m 11s
Add preliminary unit test for scores benchmarking. CI #28: Pull request #4 synchronize by amrismil
1m 12s unit-test
unit-test
1m 12s
Move test_comparison.py to the test directory CI #27: Commit 9ddbbb1 pushed by amrismil
1m 6s unit-test
unit-test
1m 6s
Add preliminary unit test for scores benchmarking. CI #26: Pull request #4 opened by amrismil
10m 37s unit-test
unit-test
10m 37s
Add preliminary unit test for scores benchmarking. CI #25: Commit 516510c pushed by amrismil
9m 23s unit-test
unit-test
9m 23s
Re-use individual interfaces.csv for summary table if present CI #24: Commit 7697e75 pushed by amrismil
9m 18s unit-test
unit-test
9m 18s
Re-use individual interfaces.csv for summary table if present CI #23: Commit 7697e75 pushed by DimaMolod
10m 58s main
main
10m 58s
hb implementation similar to HBPLUS, now takes angles into account CI #22: Commit 608ec31 pushed by DimaMolod
16m 19s main
main
16m 19s
Fix #2 CI #21: Commit 30bc02f pushed by DimaMolod
16m 14s main
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16m 14s
Update README with disclaimer on biophysical scores CI #20: Commit ee132dc pushed by DimaMolod
16m 18s main
main
16m 18s
~30% speed up due to multiple tricks CI #19: Commit 57dceae pushed by DimaMolod
16m 21s main
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16m 21s
Update README.md CI #18: Commit e6a1fa5 pushed by amrismil
21m 1s main
main
21m 1s
Few updates on newest changes CI #17: Commit 1e4d980 pushed by DimaMolod
21m 10s main
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21m 10s
Add minimal AF2/AF3 test_data samples for CI CI #16: Commit 16b7920 pushed by DimaMolod
37m 29s main
main
37m 29s
New test data, not quite pytest CI #15: Commit a514bb4 pushed by DimaMolod
17m 52s main
main
17m 52s
New CI #14: Commit 2df283e pushed by DimaMolod
13m 19s main
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13m 19s
Multiple small performance and style improvements. Run time is domina… CI #13: Commit c0978df pushed by DimaMolod
12m 59s main
main
12m 59s
Calc ipsae as symmetrical averaged and extend to nucleic acids CI #12: Commit c055e57 pushed by DimaMolod
25m 58s main
main
25m 58s
First dirty implementation of interface_sc interface_area and interfa… CI #11: Commit ad82c5a pushed by DimaMolod
25m 23s main
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25m 23s
Rank summary table by iptm CI #10: Commit 5a651a3 pushed by DimaMolod
10m 8s main
main
10m 8s
Save PAE.png for both AF2 and AF3 input CI #9: Commit bb1b423 pushed by DimaMolod
10m 15s main
main
10m 15s
New recursive CLI CI #8: Commit 914675f pushed by DimaMolod
8m 34s main
main
8m 34s