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Datasets:
THU-ATOM
/
fepplus
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Tsinghua AI-driven TransfOrmative Medicine Lab
23
Dataset card
Data Studio
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xet
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main
fepplus
/
fep_benchmark_inputs
/
structure_inputs
/
misc
3.83 MB
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1 contributor
History:
1 commit
WuKL666
Add FEPPlus benchmark and all pocket pdbs
0f8bca2
11 months ago
btk_extra_flip_edges.csv
323 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
btk_extra_flip_ligands.sdf
20.3 kB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
btk_extra_flip_protein.pdb
617 kB
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Add FEPPlus benchmark and all pocket pdbs
11 months ago
cdk8_koehler_edges.csv
444 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
cdk8_koehler_ligands.sdf
24.9 kB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
cdk8_koehler_protein.pdb
1.27 MB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
galectin3_extra_edges.csv
1.16 kB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
galectin3_extra_ligands.sdf
103 kB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
galectin3_extra_protein.pdb
333 kB
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Add FEPPlus benchmark and all pocket pdbs
11 months ago
hfaah_edges.csv
979 Bytes
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Add FEPPlus benchmark and all pocket pdbs
11 months ago
hfaah_ligands.sdf
78.7 kB
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Add FEPPlus benchmark and all pocket pdbs
11 months ago
hfaah_protein.pdb
983 kB
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11 months ago
hiv_prot_ekegren_edges.csv
542 Bytes
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11 months ago
hiv_prot_ekegren_ligands.sdf
91.4 kB
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
hiv_prot_ekegren_protein.pdb
303 kB
xet
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11 months ago
subset_metadata.csv
532 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
11 months ago
