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Datasets:
THU-ATOM
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fepplus
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Tsinghua AI-driven TransfOrmative Medicine Lab
14
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xet
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fepplus
/
fep_benchmark_inputs
/
structure_inputs
/
gpcrs
1.95 MB
1 contributor
History:
1 commit
WuKL666
Add FEPPlus benchmark and all pocket pdbs
0f8bca2
3 months ago
a2a_hip278_edges.csv
1.2 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
a2a_hip278_ligands.sdf
73.5 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
a2a_hip278_protein.pdb
376 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
ox2_hip_custcore_edges.csv
4.04 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
ox2_hip_custcore_ligands.sdf
206 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
ox2_hip_custcore_protein.pdb
394 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_meta_sub_edges.csv
1.29 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_meta_sub_ligands.sdf
66.3 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_meta_sub_protein.pdb
393 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_ortho_sub_edges.csv
753 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_ortho_sub_ligands.sdf
45 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
p2y1_ortho_sub_protein.pdb
393 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
subset_metadata.csv
419 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
