Gabriele Corso 2782769ccd added code to align apo with holo structures

2023-07-03 09:13:10 +02:00

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1a0q

add example

2023-02-11 12:33:49 -05:00

splits

first commit

2022-10-04 20:11:55 -04:00

apo_alignment.ipynb

added code to align apo with holo structures

2023-07-03 09:13:10 +02:00

protein_ligand_example_csv.csv

new version: integrated ESM + ESMFold

2023-02-10 19:56:03 -05:00

testset_csv.csv

fix testset csv and removed raise #77

2023-03-04 14:16:35 -05:00