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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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fepplus
/
fep_benchmark_inputs
/
structure_inputs
/
merck
5.31 MB
1 contributor
History:
1 commit
WuKL666
Add FEPPlus benchmark and all pocket pdbs
0f8bca2
3 months ago
cdk8_5cei_new_helix_loop_extra_edges.csv
1.8 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
cdk8_5cei_new_helix_loop_extra_ligands.sdf
146 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
cdk8_5cei_new_helix_loop_extra_protein.pdb
903 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
cmet_edges.csv
2.41 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
cmet_ligands.sdf
96.3 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
cmet_protein.pdb
410 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
eg5_extraprotomers_edges.csv
2.35 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
eg5_extraprotomers_ligands.sdf
147 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
eg5_extraprotomers_protein.pdb
487 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
hif2a_automap_edges.csv
3.08 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
hif2a_automap_ligands.sdf
141 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
hif2a_automap_protein.pdb
144 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
pfkfb3_automap_edges.csv
5.48 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
pfkfb3_automap_ligands.sdf
317 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
pfkfb3_automap_protein.pdb
693 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
shp2_edges.csv
1.55 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
shp2_ligands.sdf
85.8 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
shp2_protein.pdb
684 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
subset_metadata.csv
819 Bytes
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
syk_4puz_fullmap_edges.csv
5.3 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
syk_4puz_fullmap_ligands.sdf
213 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
syk_4puz_fullmap_protein.pdb
372 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
tnks2_fullmap_edges.csv
1.62 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
tnks2_fullmap_ligands.sdf
102 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
tnks2_fullmap_protein.pdb
348 kB
xet
Add FEPPlus benchmark and all pocket pdbs
3 months ago
