complex_id stringlengths 6 8 | ligand_pdbqt_path stringlengths 34 38 | target_pdbqt_path stringlengths 34 38 | decoys_pdbqt_path stringlengths 34 38 ⌀ | decoy_scores_csv_path stringlengths 38 42 ⌀ |
|---|---|---|---|---|
4NJ9-2M9 | data/4N/4NJ9-2M9/4NJ9-2M9_ligand.pdbqt | data/4N/4NJ9-2M9/4NJ9-2M9_target.pdbqt | data/4N/4NJ9-2M9/4NJ9-2M9_decoys.pdbqt | data/4N/4NJ9-2M9/4NJ9-2M9_decoy_scores.csv |
4NUA-RIS | data/4N/4NUA-RIS/4NUA-RIS_ligand.pdbqt | data/4N/4NUA-RIS/4NUA-RIS_target.pdbqt | data/4N/4NUA-RIS/4NUA-RIS_decoys.pdbqt | data/4N/4NUA-RIS/4NUA-RIS_decoy_scores.csv |
4N7M-2GQ | data/4N/4N7M-2GQ/4N7M-2GQ_ligand.pdbqt | data/4N/4N7M-2GQ/4N7M-2GQ_target.pdbqt | data/4N/4N7M-2GQ/4N7M-2GQ_decoys.pdbqt | data/4N/4N7M-2GQ/4N7M-2GQ_decoy_scores.csv |
4N37-MMA | data/4N/4N37-MMA/4N37-MMA_ligand.pdbqt | data/4N/4N37-MMA/4N37-MMA_target.pdbqt | data/4N/4N37-MMA/4N37-MMA_decoys.pdbqt | data/4N/4N37-MMA/4N37-MMA_decoy_scores.csv |
4NBN-2J7 | data/4N/4NBN-2J7/4NBN-2J7_ligand.pdbqt | data/4N/4NBN-2J7/4NBN-2J7_target.pdbqt | data/4N/4NBN-2J7/4NBN-2J7_decoys.pdbqt | data/4N/4NBN-2J7/4NBN-2J7_decoy_scores.csv |
4NAT-2W5 | data/4N/4NAT-2W5/4NAT-2W5_ligand.pdbqt | data/4N/4NAT-2W5/4NAT-2W5_target.pdbqt | data/4N/4NAT-2W5/4NAT-2W5_decoys.pdbqt | data/4N/4NAT-2W5/4NAT-2W5_decoy_scores.csv |
4N82-FMN | data/4N/4N82-FMN/4N82-FMN_ligand.pdbqt | data/4N/4N82-FMN/4N82-FMN_target.pdbqt | data/4N/4N82-FMN/4N82-FMN_decoys.pdbqt | data/4N/4N82-FMN/4N82-FMN_decoy_scores.csv |
4NP2-2L1 | data/4N/4NP2-2L1/4NP2-2L1_ligand.pdbqt | data/4N/4NP2-2L1/4NP2-2L1_target.pdbqt | data/4N/4NP2-2L1/4NP2-2L1_decoys.pdbqt | data/4N/4NP2-2L1/4NP2-2L1_decoy_scores.csv |
4N1O-LSA | data/4N/4N1O-LSA/4N1O-LSA_ligand.pdbqt | data/4N/4N1O-LSA/4N1O-LSA_target.pdbqt | data/4N/4N1O-LSA/4N1O-LSA_decoys.pdbqt | data/4N/4N1O-LSA/4N1O-LSA_decoy_scores.csv |
4N6S-CYC | data/4N/4N6S-CYC/4N6S-CYC_ligand.pdbqt | data/4N/4N6S-CYC/4N6S-CYC_target.pdbqt | data/4N/4N6S-CYC/4N6S-CYC_decoys.pdbqt | data/4N/4N6S-CYC/4N6S-CYC_decoy_scores.csv |
4NP9-I3P | data/4N/4NP9-I3P/4NP9-I3P_ligand.pdbqt | data/4N/4NP9-I3P/4NP9-I3P_target.pdbqt | data/4N/4NP9-I3P/4NP9-I3P_decoys.pdbqt | data/4N/4NP9-I3P/4NP9-I3P_decoy_scores.csv |
4NX6-FOL | data/4N/4NX6-FOL/4NX6-FOL_ligand.pdbqt | data/4N/4NX6-FOL/4NX6-FOL_target.pdbqt | data/4N/4NX6-FOL/4NX6-FOL_decoys.pdbqt | data/4N/4NX6-FOL/4NX6-FOL_decoy_scores.csv |
4N6G-2GQ | data/4N/4N6G-2GQ/4N6G-2GQ_ligand.pdbqt | data/4N/4N6G-2GQ/4N6G-2GQ_target.pdbqt | data/4N/4N6G-2GQ/4N6G-2GQ_decoys.pdbqt | data/4N/4N6G-2GQ/4N6G-2GQ_decoy_scores.csv |
4N54-NAI | data/4N/4N54-NAI/4N54-NAI_ligand.pdbqt | data/4N/4N54-NAI/4N54-NAI_target.pdbqt | data/4N/4N54-NAI/4N54-NAI_decoys.pdbqt | data/4N/4N54-NAI/4N54-NAI_decoy_scores.csv |
4NJ3-2KD | data/4N/4NJ3-2KD/4NJ3-2KD_ligand.pdbqt | data/4N/4NJ3-2KD/4NJ3-2KD_target.pdbqt | data/4N/4NJ3-2KD/4NJ3-2KD_decoys.pdbqt | data/4N/4NJ3-2KD/4NJ3-2KD_decoy_scores.csv |
4N0I-GLN | data/4N/4N0I-GLN/4N0I-GLN_ligand.pdbqt | data/4N/4N0I-GLN/4N0I-GLN_target.pdbqt | data/4N/4N0I-GLN/4N0I-GLN_decoys.pdbqt | data/4N/4N0I-GLN/4N0I-GLN_decoy_scores.csv |
4NRC-2LY | data/4N/4NRC-2LY/4NRC-2LY_ligand.pdbqt | data/4N/4NRC-2LY/4NRC-2LY_target.pdbqt | data/4N/4NRC-2LY/4NRC-2LY_decoys.pdbqt | data/4N/4NRC-2LY/4NRC-2LY_decoy_scores.csv |
4N07-2J9 | data/4N/4N07-2J9/4N07-2J9_ligand.pdbqt | data/4N/4N07-2J9/4N07-2J9_target.pdbqt | data/4N/4N07-2J9/4N07-2J9_decoys.pdbqt | data/4N/4N07-2J9/4N07-2J9_decoy_scores.csv |
4NZF-ARB | data/4N/4NZF-ARB/4NZF-ARB_ligand.pdbqt | data/4N/4NZF-ARB/4NZF-ARB_target.pdbqt | data/4N/4NZF-ARB/4NZF-ARB_decoys.pdbqt | data/4N/4NZF-ARB/4NZF-ARB_decoy_scores.csv |
4NE4-BTB | data/4N/4NE4-BTB/4NE4-BTB_ligand.pdbqt | data/4N/4NE4-BTB/4NE4-BTB_target.pdbqt | data/4N/4NE4-BTB/4NE4-BTB_decoys.pdbqt | data/4N/4NE4-BTB/4NE4-BTB_decoy_scores.csv |
4NBE-9FL | data/4N/4NBE-9FL/4NBE-9FL_ligand.pdbqt | data/4N/4NBE-9FL/4NBE-9FL_target.pdbqt | data/4N/4NBE-9FL/4NBE-9FL_decoys.pdbqt | data/4N/4NBE-9FL/4NBE-9FL_decoy_scores.csv |
4NW5-2NR | data/4N/4NW5-2NR/4NW5-2NR_ligand.pdbqt | data/4N/4NW5-2NR/4NW5-2NR_target.pdbqt | data/4N/4NW5-2NR/4NW5-2NR_decoys.pdbqt | data/4N/4NW5-2NR/4NW5-2NR_decoy_scores.csv |
4NW7-2O5 | data/4N/4NW7-2O5/4NW7-2O5_ligand.pdbqt | data/4N/4NW7-2O5/4NW7-2O5_target.pdbqt | data/4N/4NW7-2O5/4NW7-2O5_decoys.pdbqt | data/4N/4NW7-2O5/4NW7-2O5_decoy_scores.csv |
4N9V-AZA | data/4N/4N9V-AZA/4N9V-AZA_ligand.pdbqt | data/4N/4N9V-AZA/4N9V-AZA_target.pdbqt | null | null |
4NKW-PLO | data/4N/4NKW-PLO/4NKW-PLO_ligand.pdbqt | data/4N/4NKW-PLO/4NKW-PLO_target.pdbqt | data/4N/4NKW-PLO/4NKW-PLO_decoys.pdbqt | data/4N/4NKW-PLO/4NKW-PLO_decoy_scores.csv |
4NBS-GCP | data/4N/4NBS-GCP/4NBS-GCP_ligand.pdbqt | data/4N/4NBS-GCP/4NBS-GCP_target.pdbqt | data/4N/4NBS-GCP/4NBS-GCP_decoys.pdbqt | data/4N/4NBS-GCP/4NBS-GCP_decoy_scores.csv |
4NWX-2PG | data/4N/4NWX-2PG/4NWX-2PG_ligand.pdbqt | data/4N/4NWX-2PG/4NWX-2PG_target.pdbqt | data/4N/4NWX-2PG/4NWX-2PG_decoys.pdbqt | data/4N/4NWX-2PG/4NWX-2PG_decoy_scores.csv |
4NO7-GLC | data/4N/4NO7-GLC/4NO7-GLC_ligand.pdbqt | data/4N/4NO7-GLC/4NO7-GLC_target.pdbqt | data/4N/4NO7-GLC/4NO7-GLC_decoys.pdbqt | data/4N/4NO7-GLC/4NO7-GLC_decoy_scores.csv |
4NU1-ADP | data/4N/4NU1-ADP/4NU1-ADP_ligand.pdbqt | data/4N/4NU1-ADP/4NU1-ADP_target.pdbqt | null | null |
4NBH-9CA | data/4N/4NBH-9CA/4NBH-9CA_ligand.pdbqt | data/4N/4NBH-9CA/4NBH-9CA_target.pdbqt | data/4N/4NBH-9CA/4NBH-9CA_decoys.pdbqt | data/4N/4NBH-9CA/4NBH-9CA_decoy_scores.csv |
4N7U-2JA | data/4N/4N7U-2JA/4N7U-2JA_ligand.pdbqt | data/4N/4N7U-2JA/4N7U-2JA_target.pdbqt | data/4N/4N7U-2JA/4N7U-2JA_decoys.pdbqt | data/4N/4N7U-2JA/4N7U-2JA_decoy_scores.csv |
4NM0-ADP | data/4N/4NM0-ADP/4NM0-ADP_ligand.pdbqt | data/4N/4NM0-ADP/4NM0-ADP_target.pdbqt | data/4N/4NM0-ADP/4NM0-ADP_decoys.pdbqt | data/4N/4NM0-ADP/4NM0-ADP_decoy_scores.csv |
4NBT-NAD | data/4N/4NBT-NAD/4NBT-NAD_ligand.pdbqt | data/4N/4NBT-NAD/4NBT-NAD_target.pdbqt | data/4N/4NBT-NAD/4NBT-NAD_decoys.pdbqt | data/4N/4NBT-NAD/4NBT-NAD_decoy_scores.csv |
4NVO-556 | data/4N/4NVO-556/4NVO-556_ligand.pdbqt | data/4N/4NVO-556/4NVO-556_target.pdbqt | data/4N/4NVO-556/4NVO-556_decoys.pdbqt | data/4N/4NVO-556/4NVO-556_decoy_scores.csv |
4NCL-GDP | data/4N/4NCL-GDP/4NCL-GDP_ligand.pdbqt | data/4N/4NCL-GDP/4NCL-GDP_target.pdbqt | data/4N/4NCL-GDP/4NCL-GDP_decoys.pdbqt | data/4N/4NCL-GDP/4NCL-GDP_decoy_scores.csv |
4NXR-ANS | data/4N/4NXR-ANS/4NXR-ANS_ligand.pdbqt | data/4N/4NXR-ANS/4NXR-ANS_target.pdbqt | data/4N/4NXR-ANS/4NXR-ANS_decoys.pdbqt | data/4N/4NXR-ANS/4NXR-ANS_decoy_scores.csv |
4N8S-XXH | data/4N/4N8S-XXH/4N8S-XXH_ligand.pdbqt | data/4N/4N8S-XXH/4N8S-XXH_target.pdbqt | data/4N/4N8S-XXH/4N8S-XXH_decoys.pdbqt | data/4N/4N8S-XXH/4N8S-XXH_decoy_scores.csv |
4NCE-11H | data/4N/4NCE-11H/4NCE-11H_ligand.pdbqt | data/4N/4NCE-11H/4NCE-11H_target.pdbqt | data/4N/4NCE-11H/4NCE-11H_decoys.pdbqt | data/4N/4NCE-11H/4NCE-11H_decoy_scores.csv |
4NA9-1T7 | data/4N/4NA9-1T7/4NA9-1T7_ligand.pdbqt | data/4N/4NA9-1T7/4NA9-1T7_target.pdbqt | data/4N/4NA9-1T7/4NA9-1T7_decoys.pdbqt | data/4N/4NA9-1T7/4NA9-1T7_decoy_scores.csv |
4NV1-4TG | data/4N/4NV1-4TG/4NV1-4TG_ligand.pdbqt | data/4N/4NV1-4TG/4NV1-4TG_target.pdbqt | data/4N/4NV1-4TG/4NV1-4TG_decoys.pdbqt | data/4N/4NV1-4TG/4NV1-4TG_decoy_scores.csv |
4NZ2-2QJ | data/4N/4NZ2-2QJ/4NZ2-2QJ_ligand.pdbqt | data/4N/4NZ2-2QJ/4NZ2-2QJ_target.pdbqt | data/4N/4NZ2-2QJ/4NZ2-2QJ_decoys.pdbqt | data/4N/4NZ2-2QJ/4NZ2-2QJ_decoy_scores.csv |
4NQ6-3R9 | data/4N/4NQ6-3R9/4NQ6-3R9_ligand.pdbqt | data/4N/4NQ6-3R9/4NQ6-3R9_target.pdbqt | data/4N/4NQ6-3R9/4NQ6-3R9_decoys.pdbqt | data/4N/4NQ6-3R9/4NQ6-3R9_decoy_scores.csv |
4NOS-H2B | data/4N/4NOS-H2B/4NOS-H2B_ligand.pdbqt | data/4N/4NOS-H2B/4NOS-H2B_target.pdbqt | data/4N/4NOS-H2B/4NOS-H2B_decoys.pdbqt | data/4N/4NOS-H2B/4NOS-H2B_decoy_scores.csv |
4NRB-2LX | data/4N/4NRB-2LX/4NRB-2LX_ligand.pdbqt | data/4N/4NRB-2LX/4NRB-2LX_target.pdbqt | data/4N/4NRB-2LX/4NRB-2LX_decoys.pdbqt | data/4N/4NRB-2LX/4NRB-2LX_decoy_scores.csv |
4NVI-2NW | data/4N/4NVI-2NW/4NVI-2NW_ligand.pdbqt | data/4N/4NVI-2NW/4NVI-2NW_target.pdbqt | data/4N/4NVI-2NW/4NVI-2NW_decoys.pdbqt | data/4N/4NVI-2NW/4NVI-2NW_decoy_scores.csv |
4NN3-ORO | data/4N/4NN3-ORO/4NN3-ORO_ligand.pdbqt | data/4N/4NN3-ORO/4NN3-ORO_target.pdbqt | data/4N/4NN3-ORO/4NN3-ORO_decoys.pdbqt | data/4N/4NN3-ORO/4NN3-ORO_decoy_scores.csv |
4NKA-2K7 | data/4N/4NKA-2K7/4NKA-2K7_ligand.pdbqt | data/4N/4NKA-2K7/4NKA-2K7_target.pdbqt | data/4N/4NKA-2K7/4NKA-2K7_decoys.pdbqt | data/4N/4NKA-2K7/4NKA-2K7_decoy_scores.csv |
4N03-PLM | data/4N/4N03-PLM/4N03-PLM_ligand.pdbqt | data/4N/4N03-PLM/4N03-PLM_target.pdbqt | data/4N/4N03-PLM/4N03-PLM_decoys.pdbqt | data/4N/4N03-PLM/4N03-PLM_decoy_scores.csv |
4N3B-12V | data/4N/4N3B-12V/4N3B-12V_ligand.pdbqt | data/4N/4N3B-12V/4N3B-12V_target.pdbqt | data/4N/4N3B-12V/4N3B-12V_decoys.pdbqt | data/4N/4N3B-12V/4N3B-12V_decoy_scores.csv |
4NK3-MK7 | data/4N/4NK3-MK7/4NK3-MK7_ligand.pdbqt | data/4N/4NK3-MK7/4NK3-MK7_target.pdbqt | data/4N/4NK3-MK7/4NK3-MK7_decoys.pdbqt | data/4N/4NK3-MK7/4NK3-MK7_decoy_scores.csv |
4N07-GLU | data/4N/4N07-GLU/4N07-GLU_ligand.pdbqt | data/4N/4N07-GLU/4N07-GLU_target.pdbqt | data/4N/4N07-GLU/4N07-GLU_decoys.pdbqt | data/4N/4N07-GLU/4N07-GLU_decoy_scores.csv |
4NT0-3DU | data/4N/4NT0-3DU/4NT0-3DU_ligand.pdbqt | data/4N/4NT0-3DU/4NT0-3DU_target.pdbqt | data/4N/4NT0-3DU/4NT0-3DU_decoys.pdbqt | data/4N/4NT0-3DU/4NT0-3DU_decoy_scores.csv |
4NF8-GLU | data/4N/4NF8-GLU/4NF8-GLU_ligand.pdbqt | data/4N/4NF8-GLU/4NF8-GLU_target.pdbqt | data/4N/4NF8-GLU/4NF8-GLU_decoys.pdbqt | data/4N/4NF8-GLU/4NF8-GLU_decoy_scores.csv |
4N8Y-ADA | data/4N/4N8Y-ADA/4N8Y-ADA_ligand.pdbqt | data/4N/4N8Y-ADA/4N8Y-ADA_target.pdbqt | data/4N/4N8Y-ADA/4N8Y-ADA_decoys.pdbqt | data/4N/4N8Y-ADA/4N8Y-ADA_decoy_scores.csv |
4NBW-NAD | data/4N/4NBW-NAD/4NBW-NAD_ligand.pdbqt | data/4N/4NBW-NAD/4NBW-NAD_target.pdbqt | data/4N/4NBW-NAD/4NBW-NAD_decoys.pdbqt | data/4N/4NBW-NAD/4NBW-NAD_decoy_scores.csv |
4NAX-GDS | data/4N/4NAX-GDS/4NAX-GDS_ligand.pdbqt | data/4N/4NAX-GDS/4NAX-GDS_target.pdbqt | data/4N/4NAX-GDS/4NAX-GDS_decoys.pdbqt | data/4N/4NAX-GDS/4NAX-GDS_decoy_scores.csv |
4NDN-PPK | data/4N/4NDN-PPK/4NDN-PPK_ligand.pdbqt | data/4N/4NDN-PPK/4NDN-PPK_target.pdbqt | data/4N/4NDN-PPK/4NDN-PPK_decoys.pdbqt | data/4N/4NDN-PPK/4NDN-PPK_decoy_scores.csv |
4NYV-15E | data/4N/4NYV-15E/4NYV-15E_ligand.pdbqt | data/4N/4NYV-15E/4NYV-15E_target.pdbqt | data/4N/4NYV-15E/4NYV-15E_decoys.pdbqt | data/4N/4NYV-15E/4NYV-15E_decoy_scores.csv |
4NOT-XMM | data/4N/4NOT-XMM/4NOT-XMM_ligand.pdbqt | data/4N/4NOT-XMM/4NOT-XMM_target.pdbqt | data/4N/4NOT-XMM/4NOT-XMM_decoys.pdbqt | data/4N/4NOT-XMM/4NOT-XMM_decoy_scores.csv |
4NX2-2LT | data/4N/4NX2-2LT/4NX2-2LT_ligand.pdbqt | data/4N/4NX2-2LT/4NX2-2LT_target.pdbqt | data/4N/4NX2-2LT/4NX2-2LT_decoys.pdbqt | data/4N/4NX2-2LT/4NX2-2LT_decoy_scores.csv |
4NEV-2JR | data/4N/4NEV-2JR/4NEV-2JR_ligand.pdbqt | data/4N/4NEV-2JR/4NEV-2JR_target.pdbqt | data/4N/4NEV-2JR/4NEV-2JR_decoys.pdbqt | data/4N/4NEV-2JR/4NEV-2JR_decoy_scores.csv |
4NWJ-3PG | data/4N/4NWJ-3PG/4NWJ-3PG_ligand.pdbqt | data/4N/4NWJ-3PG/4NWJ-3PG_target.pdbqt | data/4N/4NWJ-3PG/4NWJ-3PG_decoys.pdbqt | data/4N/4NWJ-3PG/4NWJ-3PG_decoy_scores.csv |
4NUL-FMN | data/4N/4NUL-FMN/4NUL-FMN_ligand.pdbqt | data/4N/4NUL-FMN/4NUL-FMN_target.pdbqt | data/4N/4NUL-FMN/4NUL-FMN_decoys.pdbqt | data/4N/4NUL-FMN/4NUL-FMN_decoy_scores.csv |
4NBB-9CA | data/4N/4NBB-9CA/4NBB-9CA_ligand.pdbqt | data/4N/4NBB-9CA/4NBB-9CA_target.pdbqt | data/4N/4NBB-9CA/4NBB-9CA_decoys.pdbqt | data/4N/4NBB-9CA/4NBB-9CA_decoy_scores.csv |
4NXG-FMN | data/4N/4NXG-FMN/4NXG-FMN_ligand.pdbqt | data/4N/4NXG-FMN/4NXG-FMN_target.pdbqt | data/4N/4NXG-FMN/4NXG-FMN_decoys.pdbqt | data/4N/4NXG-FMN/4NXG-FMN_decoy_scores.csv |
4NI8-1WB | data/4N/4NI8-1WB/4NI8-1WB_ligand.pdbqt | data/4N/4NI8-1WB/4NI8-1WB_target.pdbqt | data/4N/4NI8-1WB/4NI8-1WB_decoys.pdbqt | data/4N/4NI8-1WB/4NI8-1WB_decoy_scores.csv |
4NW6-2NS | data/4N/4NW6-2NS/4NW6-2NS_ligand.pdbqt | data/4N/4NW6-2NS/4NW6-2NS_target.pdbqt | data/4N/4NW6-2NS/4NW6-2NS_decoys.pdbqt | data/4N/4NW6-2NS/4NW6-2NS_decoy_scores.csv |
4N1Z-N1Z | data/4N/4N1Z-N1Z/4N1Z-N1Z_ligand.pdbqt | data/4N/4N1Z-N1Z/4N1Z-N1Z_target.pdbqt | data/4N/4N1Z-N1Z/4N1Z-N1Z_decoys.pdbqt | data/4N/4N1Z-N1Z/4N1Z-N1Z_decoy_scores.csv |
4N5R-DO3 | data/4N/4N5R-DO3/4N5R-DO3_ligand.pdbqt | data/4N/4N5R-DO3/4N5R-DO3_target.pdbqt | null | null |
4NEZ-4NE | data/4N/4NEZ-4NE/4NEZ-4NE_ligand.pdbqt | data/4N/4NEZ-4NE/4NEZ-4NE_target.pdbqt | data/4N/4NEZ-4NE/4NEZ-4NE_decoys.pdbqt | data/4N/4NEZ-4NE/4NEZ-4NE_decoy_scores.csv |
4NZ4-NDG | data/4N/4NZ4-NDG/4NZ4-NDG_ligand.pdbqt | data/4N/4NZ4-NDG/4NZ4-NDG_target.pdbqt | data/4N/4NZ4-NDG/4NZ4-NDG_decoys.pdbqt | data/4N/4NZ4-NDG/4NZ4-NDG_decoy_scores.csv |
4NG3-1DF | data/4N/4NG3-1DF/4NG3-1DF_ligand.pdbqt | data/4N/4NG3-1DF/4NG3-1DF_target.pdbqt | data/4N/4NG3-1DF/4NG3-1DF_decoys.pdbqt | data/4N/4NG3-1DF/4NG3-1DF_decoy_scores.csv |
4NG6-RIS | data/4N/4NG6-RIS/4NG6-RIS_ligand.pdbqt | data/4N/4NG6-RIS/4NG6-RIS_target.pdbqt | data/4N/4NG6-RIS/4NG6-RIS_decoys.pdbqt | data/4N/4NG6-RIS/4NG6-RIS_decoy_scores.csv |
4NJK-SAM | data/4N/4NJK-SAM/4NJK-SAM_ligand.pdbqt | data/4N/4NJK-SAM/4NJK-SAM_target.pdbqt | data/4N/4NJK-SAM/4NJK-SAM_decoys.pdbqt | data/4N/4NJK-SAM/4NJK-SAM_decoy_scores.csv |
4NFN-2KC | data/4N/4NFN-2KC/4NFN-2KC_ligand.pdbqt | data/4N/4NFN-2KC/4NFN-2KC_target.pdbqt | data/4N/4NFN-2KC/4NFN-2KC_decoys.pdbqt | data/4N/4NFN-2KC/4NFN-2KC_decoy_scores.csv |
4NQJ-LMT | data/4N/4NQJ-LMT/4NQJ-LMT_ligand.pdbqt | data/4N/4NQJ-LMT/4NQJ-LMT_target.pdbqt | data/4N/4NQJ-LMT/4NQJ-LMT_decoys.pdbqt | data/4N/4NQJ-LMT/4NQJ-LMT_decoy_scores.csv |
4NAE-1GP | data/4N/4NAE-1GP/4NAE-1GP_ligand.pdbqt | data/4N/4NAE-1GP/4NAE-1GP_target.pdbqt | data/4N/4NAE-1GP/4NAE-1GP_decoys.pdbqt | data/4N/4NAE-1GP/4NAE-1GP_decoy_scores.csv |
4NGA-2KF | data/4N/4NGA-2KF/4NGA-2KF_ligand.pdbqt | data/4N/4NGA-2KF/4NGA-2KF_target.pdbqt | data/4N/4NGA-2KF/4NGA-2KF_decoys.pdbqt | data/4N/4NGA-2KF/4NGA-2KF_decoy_scores.csv |
4NIR-6DH | data/4N/4NIR-6DH/4NIR-6DH_ligand.pdbqt | data/4N/4NIR-6DH/4NIR-6DH_target.pdbqt | data/4N/4NIR-6DH/4NIR-6DH_decoys.pdbqt | data/4N/4NIR-6DH/4NIR-6DH_decoy_scores.csv |
4NIF-ANP | data/4N/4NIF-ANP/4NIF-ANP_ligand.pdbqt | data/4N/4NIF-ANP/4NIF-ANP_target.pdbqt | data/4N/4NIF-ANP/4NIF-ANP_decoys.pdbqt | data/4N/4NIF-ANP/4NIF-ANP_decoy_scores.csv |
4NR6-2LN | data/4N/4NR6-2LN/4NR6-2LN_ligand.pdbqt | data/4N/4NR6-2LN/4NR6-2LN_target.pdbqt | data/4N/4NR6-2LN/4NR6-2LN_decoys.pdbqt | data/4N/4NR6-2LN/4NR6-2LN_decoy_scores.csv |
4NZ6-DGL | data/4N/4NZ6-DGL/4NZ6-DGL_ligand.pdbqt | data/4N/4NZ6-DGL/4NZ6-DGL_target.pdbqt | data/4N/4NZ6-DGL/4NZ6-DGL_decoys.pdbqt | data/4N/4NZ6-DGL/4NZ6-DGL_decoy_scores.csv |
4N9K-CED | data/4N/4N9K-CED/4N9K-CED_ligand.pdbqt | data/4N/4N9K-CED/4N9K-CED_target.pdbqt | data/4N/4N9K-CED/4N9K-CED_decoys.pdbqt | data/4N/4N9K-CED/4N9K-CED_decoy_scores.csv |
4N3M-AZA | data/4N/4N3M-AZA/4N3M-AZA_ligand.pdbqt | data/4N/4N3M-AZA/4N3M-AZA_target.pdbqt | null | null |
4NP3-2L2 | data/4N/4NP3-2L2/4NP3-2L2_ligand.pdbqt | data/4N/4NP3-2L2/4NP3-2L2_target.pdbqt | data/4N/4NP3-2L2/4NP3-2L2_decoys.pdbqt | data/4N/4NP3-2L2/4NP3-2L2_decoy_scores.csv |
4NVQ-2OD | data/4N/4NVQ-2OD/4NVQ-2OD_ligand.pdbqt | data/4N/4NVQ-2OD/4NVQ-2OD_target.pdbqt | data/4N/4NVQ-2OD/4NVQ-2OD_decoys.pdbqt | data/4N/4NVQ-2OD/4NVQ-2OD_decoy_scores.csv |
4NFS-NAJ | data/4N/4NFS-NAJ/4NFS-NAJ_ligand.pdbqt | data/4N/4NFS-NAJ/4NFS-NAJ_target.pdbqt | data/4N/4NFS-NAJ/4NFS-NAJ_decoys.pdbqt | data/4N/4NFS-NAJ/4NFS-NAJ_decoy_scores.csv |
4N9U-RIS | data/4N/4N9U-RIS/4N9U-RIS_ligand.pdbqt | data/4N/4N9U-RIS/4N9U-RIS_target.pdbqt | data/4N/4N9U-RIS/4N9U-RIS_decoys.pdbqt | data/4N/4N9U-RIS/4N9U-RIS_decoy_scores.csv |
4N10-MPO | data/4N/4N10-MPO/4N10-MPO_ligand.pdbqt | data/4N/4N10-MPO/4N10-MPO_target.pdbqt | null | null |
4NUG-P6G | data/4N/4NUG-P6G/4NUG-P6G_ligand.pdbqt | data/4N/4NUG-P6G/4NUG-P6G_target.pdbqt | data/4N/4NUG-P6G/4NUG-P6G_decoys.pdbqt | data/4N/4NUG-P6G/4NUG-P6G_decoy_scores.csv |
4N4D-BNG | data/4N/4N4D-BNG/4N4D-BNG_ligand.pdbqt | data/4N/4N4D-BNG/4N4D-BNG_target.pdbqt | data/4N/4N4D-BNG/4N4D-BNG_decoys.pdbqt | data/4N/4N4D-BNG/4N4D-BNG_decoy_scores.csv |
4NSX-FLC | data/4N/4NSX-FLC/4NSX-FLC_ligand.pdbqt | data/4N/4NSX-FLC/4NSX-FLC_target.pdbqt | data/4N/4NSX-FLC/4NSX-FLC_decoys.pdbqt | data/4N/4NSX-FLC/4NSX-FLC_decoy_scores.csv |
4NI1-2JX | data/4N/4NI1-2JX/4NI1-2JX_ligand.pdbqt | data/4N/4NI1-2JX/4NI1-2JX_target.pdbqt | data/4N/4NI1-2JX/4NI1-2JX_decoys.pdbqt | data/4N/4NI1-2JX/4NI1-2JX_decoy_scores.csv |
4N4E-2G6 | data/4N/4N4E-2G6/4N4E-2G6_ligand.pdbqt | data/4N/4N4E-2G6/4N4E-2G6_target.pdbqt | data/4N/4N4E-2G6/4N4E-2G6_decoys.pdbqt | data/4N/4N4E-2G6/4N4E-2G6_decoy_scores.csv |
4NJH-SAM | data/4N/4NJH-SAM/4NJH-SAM_ligand.pdbqt | data/4N/4NJH-SAM/4NJH-SAM_target.pdbqt | data/4N/4NJH-SAM/4NJH-SAM_decoys.pdbqt | data/4N/4NJH-SAM/4NJH-SAM_decoy_scores.csv |
4NAN-2JM | data/4N/4NAN-2JM/4NAN-2JM_ligand.pdbqt | data/4N/4NAN-2JM/4NAN-2JM_target.pdbqt | data/4N/4NAN-2JM/4NAN-2JM_decoys.pdbqt | data/4N/4NAN-2JM/4NAN-2JM_decoy_scores.csv |
4NIE-NBH | data/4N/4NIE-NBH/4NIE-NBH_ligand.pdbqt | data/4N/4NIE-NBH/4NIE-NBH_target.pdbqt | data/4N/4NIE-NBH/4NIE-NBH_decoys.pdbqt | data/4N/4NIE-NBH/4NIE-NBH_decoy_scores.csv |
4N9A-2J2 | data/4N/4N9A-2J2/4N9A-2J2_ligand.pdbqt | data/4N/4N9A-2J2/4N9A-2J2_target.pdbqt | data/4N/4N9A-2J2/4N9A-2J2_decoys.pdbqt | data/4N/4N9A-2J2/4N9A-2J2_decoy_scores.csv |
4NAK-PBQ | data/4N/4NAK-PBQ/4NAK-PBQ_ligand.pdbqt | data/4N/4NAK-PBQ/4NAK-PBQ_target.pdbqt | data/4N/4NAK-PBQ/4NAK-PBQ_decoys.pdbqt | data/4N/4NAK-PBQ/4NAK-PBQ_decoy_scores.csv |
4NA4-A1R | data/4N/4NA4-A1R/4NA4-A1R_ligand.pdbqt | data/4N/4NA4-A1R/4NA4-A1R_target.pdbqt | data/4N/4NA4-A1R/4NA4-A1R_decoys.pdbqt | data/4N/4NA4-A1R/4NA4-A1R_decoy_scores.csv |
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