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 ⌀ |
|---|---|---|---|---|
3G9E-RO7 | data/3G/3G9E-RO7/3G9E-RO7_ligand.pdbqt | data/3G/3G9E-RO7/3G9E-RO7_target.pdbqt | data/3G/3G9E-RO7/3G9E-RO7_decoys.pdbqt | data/3G/3G9E-RO7/3G9E-RO7_decoy_scores.csv |
3GE6-FMN | data/3G/3GE6-FMN/3GE6-FMN_ligand.pdbqt | data/3G/3GE6-FMN/3GE6-FMN_target.pdbqt | data/3G/3GE6-FMN/3GE6-FMN_decoys.pdbqt | data/3G/3GE6-FMN/3GE6-FMN_decoy_scores.csv |
3G1F-2OM | data/3G/3G1F-2OM/3G1F-2OM_ligand.pdbqt | data/3G/3G1F-2OM/3G1F-2OM_target.pdbqt | data/3G/3G1F-2OM/3G1F-2OM_decoys.pdbqt | data/3G/3G1F-2OM/3G1F-2OM_decoy_scores.csv |
3G3V-MTN | data/3G/3G3V-MTN/3G3V-MTN_ligand.pdbqt | data/3G/3G3V-MTN/3G3V-MTN_target.pdbqt | data/3G/3G3V-MTN/3G3V-MTN_decoys.pdbqt | data/3G/3G3V-MTN/3G3V-MTN_decoy_scores.csv |
3G5E-Q74 | data/3G/3G5E-Q74/3G5E-Q74_ligand.pdbqt | data/3G/3G5E-Q74/3G5E-Q74_target.pdbqt | data/3G/3G5E-Q74/3G5E-Q74_decoys.pdbqt | data/3G/3G5E-Q74/3G5E-Q74_decoy_scores.csv |
3G8B-SAM | data/3G/3G8B-SAM/3G8B-SAM_ligand.pdbqt | data/3G/3G8B-SAM/3G8B-SAM_target.pdbqt | data/3G/3G8B-SAM/3G8B-SAM_decoys.pdbqt | data/3G/3G8B-SAM/3G8B-SAM_decoy_scores.csv |
3GJ8-GDP | data/3G/3GJ8-GDP/3GJ8-GDP_ligand.pdbqt | data/3G/3GJ8-GDP/3GJ8-GDP_target.pdbqt | data/3G/3GJ8-GDP/3GJ8-GDP_decoys.pdbqt | data/3G/3GJ8-GDP/3GJ8-GDP_decoy_scores.csv |
3GMD-2M3 | data/3G/3GMD-2M3/3GMD-2M3_ligand.pdbqt | data/3G/3GMD-2M3/3GMD-2M3_target.pdbqt | data/3G/3GMD-2M3/3GMD-2M3_decoys.pdbqt | data/3G/3GMD-2M3/3GMD-2M3_decoy_scores.csv |
3G6M-CFF | data/3G/3G6M-CFF/3G6M-CFF_ligand.pdbqt | data/3G/3G6M-CFF/3G6M-CFF_target.pdbqt | data/3G/3G6M-CFF/3G6M-CFF_decoys.pdbqt | data/3G/3G6M-CFF/3G6M-CFF_decoy_scores.csv |
3GVD-PG5 | data/3G/3GVD-PG5/3GVD-PG5_ligand.pdbqt | data/3G/3GVD-PG5/3GVD-PG5_target.pdbqt | data/3G/3GVD-PG5/3GVD-PG5_decoys.pdbqt | data/3G/3GVD-PG5/3GVD-PG5_decoy_scores.csv |
7RAD-ZGJ | data/7R/7RAD-ZGJ/7RAD-ZGJ_ligand.pdbqt | data/7R/7RAD-ZGJ/7RAD-ZGJ_target.pdbqt | data/7R/7RAD-ZGJ/7RAD-ZGJ_decoys.pdbqt | data/7R/7RAD-ZGJ/7RAD-ZGJ_decoy_scores.csv |
7RW5-7U2 | data/7R/7RW5-7U2/7RW5-7U2_ligand.pdbqt | data/7R/7RW5-7U2/7RW5-7U2_target.pdbqt | data/7R/7RW5-7U2/7RW5-7U2_decoys.pdbqt | data/7R/7RW5-7U2/7RW5-7U2_decoy_scores.csv |
7RT1-7L8 | data/7R/7RT1-7L8/7RT1-7L8_ligand.pdbqt | data/7R/7RT1-7L8/7RT1-7L8_target.pdbqt | data/7R/7RT1-7L8/7RT1-7L8_decoys.pdbqt | data/7R/7RT1-7L8/7RT1-7L8_decoy_scores.csv |
7RVW-7YB | data/7R/7RVW-7YB/7RVW-7YB_ligand.pdbqt | data/7R/7RVW-7YB/7RVW-7YB_target.pdbqt | data/7R/7RVW-7YB/7RVW-7YB_decoys.pdbqt | data/7R/7RVW-7YB/7RVW-7YB_decoy_scores.csv |
7R2L-UX5 | data/7R/7R2L-UX5/7R2L-UX5_ligand.pdbqt | data/7R/7R2L-UX5/7R2L-UX5_target.pdbqt | data/7R/7R2L-UX5/7R2L-UX5_decoys.pdbqt | data/7R/7R2L-UX5/7R2L-UX5_decoy_scores.csv |
7RS7-73I | data/7R/7RS7-73I/7RS7-73I_ligand.pdbqt | data/7R/7RS7-73I/7RS7-73I_target.pdbqt | data/7R/7RS7-73I/7RS7-73I_decoys.pdbqt | data/7R/7RS7-73I/7RS7-73I_decoy_scores.csv |
7R49-PNS | data/7R/7R49-PNS/7R49-PNS_ligand.pdbqt | data/7R/7R49-PNS/7R49-PNS_target.pdbqt | data/7R/7R49-PNS/7R49-PNS_decoys.pdbqt | data/7R/7R49-PNS/7R49-PNS_decoy_scores.csv |
7RPB-MER | data/7R/7RPB-MER/7RPB-MER_ligand.pdbqt | data/7R/7RPB-MER/7RPB-MER_target.pdbqt | data/7R/7RPB-MER/7RPB-MER_decoys.pdbqt | data/7R/7RPB-MER/7RPB-MER_decoy_scores.csv |
7RXW-MTA | data/7R/7RXW-MTA/7RXW-MTA_ligand.pdbqt | data/7R/7RXW-MTA/7RXW-MTA_target.pdbqt | data/7R/7RXW-MTA/7RXW-MTA_decoys.pdbqt | data/7R/7RXW-MTA/7RXW-MTA_decoy_scores.csv |
7RSV-7IQ | data/7R/7RSV-7IQ/7RSV-7IQ_ligand.pdbqt | data/7R/7RSV-7IQ/7RSV-7IQ_target.pdbqt | data/7R/7RSV-7IQ/7RSV-7IQ_decoys.pdbqt | data/7R/7RSV-7IQ/7RSV-7IQ_decoy_scores.csv |
7RKL-5R4 | data/7R/7RKL-5R4/7RKL-5R4_ligand.pdbqt | data/7R/7RKL-5R4/7RKL-5R4_target.pdbqt | data/7R/7RKL-5R4/7RKL-5R4_decoys.pdbqt | data/7R/7RKL-5R4/7RKL-5R4_decoy_scores.csv |
7RNH-5ZW | data/7R/7RNH-5ZW/7RNH-5ZW_ligand.pdbqt | data/7R/7RNH-5ZW/7RNH-5ZW_target.pdbqt | data/7R/7RNH-5ZW/7RNH-5ZW_decoys.pdbqt | data/7R/7RNH-5ZW/7RNH-5ZW_decoy_scores.csv |
7RTQ-7PW | data/7R/7RTQ-7PW/7RTQ-7PW_ligand.pdbqt | data/7R/7RTQ-7PW/7RTQ-7PW_target.pdbqt | data/7R/7RTQ-7PW/7RTQ-7PW_decoys.pdbqt | data/7R/7RTQ-7PW/7RTQ-7PW_decoy_scores.csv |
7RZL-FMN | data/7R/7RZL-FMN/7RZL-FMN_ligand.pdbqt | data/7R/7RZL-FMN/7RZL-FMN_target.pdbqt | data/7R/7RZL-FMN/7RZL-FMN_decoys.pdbqt | data/7R/7RZL-FMN/7RZL-FMN_decoy_scores.csv |
7R7H-4IT | data/7R/7R7H-4IT/7R7H-4IT_ligand.pdbqt | data/7R/7R7H-4IT/7R7H-4IT_target.pdbqt | data/7R/7R7H-4IT/7R7H-4IT_decoys.pdbqt | data/7R/7R7H-4IT/7R7H-4IT_decoy_scores.csv |
7RY4-J3Z | data/7R/7RY4-J3Z/7RY4-J3Z_ligand.pdbqt | data/7R/7RY4-J3Z/7RY4-J3Z_target.pdbqt | data/7R/7RY4-J3Z/7RY4-J3Z_decoys.pdbqt | data/7R/7RY4-J3Z/7RY4-J3Z_decoy_scores.csv |
7RS4-7I0 | data/7R/7RS4-7I0/7RS4-7I0_ligand.pdbqt | data/7R/7RS4-7I0/7RS4-7I0_target.pdbqt | data/7R/7RS4-7I0/7RS4-7I0_decoys.pdbqt | data/7R/7RS4-7I0/7RS4-7I0_decoy_scores.csv |
7RF9-BTB | data/7R/7RF9-BTB/7RF9-BTB_ligand.pdbqt | data/7R/7RF9-BTB/7RF9-BTB_target.pdbqt | data/7R/7RF9-BTB/7RF9-BTB_decoys.pdbqt | data/7R/7RF9-BTB/7RF9-BTB_decoy_scores.csv |
7RZC-JWX | data/7R/7RZC-JWX/7RZC-JWX_ligand.pdbqt | data/7R/7RZC-JWX/7RZC-JWX_target.pdbqt | data/7R/7RZC-JWX/7RZC-JWX_decoys.pdbqt | data/7R/7RZC-JWX/7RZC-JWX_decoy_scores.csv |
7RGL-IMP | data/7R/7RGL-IMP/7RGL-IMP_ligand.pdbqt | data/7R/7RGL-IMP/7RGL-IMP_target.pdbqt | data/7R/7RGL-IMP/7RGL-IMP_decoys.pdbqt | data/7R/7RGL-IMP/7RGL-IMP_decoy_scores.csv |
7REG-4SI | data/7R/7REG-4SI/7REG-4SI_ligand.pdbqt | data/7R/7REG-4SI/7REG-4SI_target.pdbqt | data/7R/7REG-4SI/7REG-4SI_decoys.pdbqt | data/7R/7REG-4SI/7REG-4SI_decoy_scores.csv |
7R4C-LMT | data/7R/7R4C-LMT/7R4C-LMT_ligand.pdbqt | data/7R/7R4C-LMT/7R4C-LMT_target.pdbqt | data/7R/7R4C-LMT/7R4C-LMT_decoys.pdbqt | data/7R/7R4C-LMT/7R4C-LMT_decoy_scores.csv |
7RI0-2PG | data/7R/7RI0-2PG/7RI0-2PG_ligand.pdbqt | data/7R/7RI0-2PG/7RI0-2PG_target.pdbqt | data/7R/7RI0-2PG/7RI0-2PG_decoys.pdbqt | data/7R/7RI0-2PG/7RI0-2PG_decoy_scores.csv |
7RJ1-TRP | data/7R/7RJ1-TRP/7RJ1-TRP_ligand.pdbqt | data/7R/7RJ1-TRP/7RJ1-TRP_target.pdbqt | data/7R/7RJ1-TRP/7RJ1-TRP_decoys.pdbqt | data/7R/7RJ1-TRP/7RJ1-TRP_decoy_scores.csv |
7RM2-5YJ | data/7R/7RM2-5YJ/7RM2-5YJ_ligand.pdbqt | data/7R/7RM2-5YJ/7RM2-5YJ_target.pdbqt | data/7R/7RM2-5YJ/7RM2-5YJ_decoys.pdbqt | data/7R/7RM2-5YJ/7RM2-5YJ_decoy_scores.csv |
7RVM-7V2 | data/7R/7RVM-7V2/7RVM-7V2_ligand.pdbqt | data/7R/7RVM-7V2/7RVM-7V2_target.pdbqt | data/7R/7RVM-7V2/7RVM-7V2_decoys.pdbqt | data/7R/7RVM-7V2/7RVM-7V2_decoy_scores.csv |
7R34-STE | data/7R/7R34-STE/7R34-STE_ligand.pdbqt | data/7R/7R34-STE/7R34-STE_target.pdbqt | data/7R/7R34-STE/7R34-STE_decoys.pdbqt | data/7R/7R34-STE/7R34-STE_decoy_scores.csv |
7R41-LMT | data/7R/7R41-LMT/7R41-LMT_ligand.pdbqt | data/7R/7R41-LMT/7R41-LMT_target.pdbqt | data/7R/7R41-LMT/7R41-LMT_decoys.pdbqt | data/7R/7R41-LMT/7R41-LMT_decoy_scores.csv |
7RIO-5YX | data/7R/7RIO-5YX/7RIO-5YX_ligand.pdbqt | data/7R/7RIO-5YX/7RIO-5YX_target.pdbqt | data/7R/7RIO-5YX/7RIO-5YX_decoys.pdbqt | data/7R/7RIO-5YX/7RIO-5YX_decoy_scores.csv |
7RC6-SAH | data/7R/7RC6-SAH/7RC6-SAH_ligand.pdbqt | data/7R/7RC6-SAH/7RC6-SAH_target.pdbqt | data/7R/7RC6-SAH/7RC6-SAH_decoys.pdbqt | data/7R/7RC6-SAH/7RC6-SAH_decoy_scores.csv |
7RCM-ADP | data/7R/7RCM-ADP/7RCM-ADP_ligand.pdbqt | data/7R/7RCM-ADP/7RCM-ADP_target.pdbqt | data/7R/7RCM-ADP/7RCM-ADP_decoys.pdbqt | data/7R/7RCM-ADP/7RCM-ADP_decoy_scores.csv |
7RLS-5YN | data/7R/7RLS-5YN/7RLS-5YN_ligand.pdbqt | data/7R/7RLS-5YN/7RLS-5YN_target.pdbqt | data/7R/7RLS-5YN/7RLS-5YN_decoys.pdbqt | data/7R/7RLS-5YN/7RLS-5YN_decoy_scores.csv |
7R1I-HIH | data/7R/7R1I-HIH/7R1I-HIH_ligand.pdbqt | data/7R/7R1I-HIH/7R1I-HIH_target.pdbqt | data/7R/7R1I-HIH/7R1I-HIH_decoys.pdbqt | data/7R/7R1I-HIH/7R1I-HIH_decoy_scores.csv |
7R33-STE | data/7R/7R33-STE/7R33-STE_ligand.pdbqt | data/7R/7R33-STE/7R33-STE_target.pdbqt | data/7R/7R33-STE/7R33-STE_decoys.pdbqt | data/7R/7R33-STE/7R33-STE_decoy_scores.csv |
7R2I-UPZ | data/7R/7R2I-UPZ/7R2I-UPZ_ligand.pdbqt | data/7R/7R2I-UPZ/7R2I-UPZ_target.pdbqt | data/7R/7R2I-UPZ/7R2I-UPZ_decoys.pdbqt | data/7R/7R2I-UPZ/7R2I-UPZ_decoy_scores.csv |
7R2W-ANP | data/7R/7R2W-ANP/7R2W-ANP_ligand.pdbqt | data/7R/7R2W-ANP/7R2W-ANP_target.pdbqt | data/7R/7R2W-ANP/7R2W-ANP_decoys.pdbqt | data/7R/7R2W-ANP/7R2W-ANP_decoy_scores.csv |
7RPD-1RG | data/7R/7RPD-1RG/7RPD-1RG_ligand.pdbqt | data/7R/7RPD-1RG/7RPD-1RG_target.pdbqt | data/7R/7RPD-1RG/7RPD-1RG_decoys.pdbqt | data/7R/7RPD-1RG/7RPD-1RG_decoy_scores.csv |
7R44-LMT | data/7R/7R44-LMT/7R44-LMT_ligand.pdbqt | data/7R/7R44-LMT/7R44-LMT_target.pdbqt | data/7R/7R44-LMT/7R44-LMT_decoys.pdbqt | data/7R/7R44-LMT/7R44-LMT_decoy_scores.csv |
7R50-5GP | data/7R/7R50-5GP/7R50-5GP_ligand.pdbqt | data/7R/7R50-5GP/7R50-5GP_target.pdbqt | data/7R/7R50-5GP/7R50-5GP_decoys.pdbqt | data/7R/7R50-5GP/7R50-5GP_decoy_scores.csv |
7R48-GTP | data/7R/7R48-GTP/7R48-GTP_ligand.pdbqt | data/7R/7R48-GTP/7R48-GTP_target.pdbqt | data/7R/7R48-GTP/7R48-GTP_decoys.pdbqt | data/7R/7R48-GTP/7R48-GTP_decoy_scores.csv |
7R0U-V55 | data/7R/7R0U-V55/7R0U-V55_ligand.pdbqt | data/7R/7R0U-V55/7R0U-V55_target.pdbqt | data/7R/7R0U-V55/7R0U-V55_decoys.pdbqt | data/7R/7R0U-V55/7R0U-V55_decoy_scores.csv |
7RSM-2L5 | data/7R/7RSM-2L5/7RSM-2L5_ligand.pdbqt | data/7R/7RSM-2L5/7RSM-2L5_target.pdbqt | data/7R/7RSM-2L5/7RSM-2L5_decoys.pdbqt | data/7R/7RSM-2L5/7RSM-2L5_decoy_scores.csv |
7R4D-LMT | data/7R/7R4D-LMT/7R4D-LMT_ligand.pdbqt | data/7R/7R4D-LMT/7R4D-LMT_target.pdbqt | data/7R/7R4D-LMT/7R4D-LMT_decoys.pdbqt | data/7R/7R4D-LMT/7R4D-LMT_decoy_scores.csv |
7RRY-L84 | data/7R/7RRY-L84/7RRY-L84_ligand.pdbqt | data/7R/7RRY-L84/7RRY-L84_target.pdbqt | data/7R/7RRY-L84/7RRY-L84_decoys.pdbqt | data/7R/7RRY-L84/7RRY-L84_decoy_scores.csv |
7RN2-5ZQ | data/7R/7RN2-5ZQ/7RN2-5ZQ_ligand.pdbqt | data/7R/7RN2-5ZQ/7RN2-5ZQ_target.pdbqt | data/7R/7RN2-5ZQ/7RN2-5ZQ_decoys.pdbqt | data/7R/7RN2-5ZQ/7RN2-5ZQ_decoy_scores.csv |
7RNK-5ZT | data/7R/7RNK-5ZT/7RNK-5ZT_ligand.pdbqt | data/7R/7RNK-5ZT/7RNK-5ZT_target.pdbqt | data/7R/7RNK-5ZT/7RNK-5ZT_decoys.pdbqt | data/7R/7RNK-5ZT/7RNK-5ZT_decoy_scores.csv |
7RBZ-4IJ | data/7R/7RBZ-4IJ/7RBZ-4IJ_ligand.pdbqt | data/7R/7RBZ-4IJ/7RBZ-4IJ_target.pdbqt | data/7R/7RBZ-4IJ/7RBZ-4IJ_decoys.pdbqt | data/7R/7RBZ-4IJ/7RBZ-4IJ_decoy_scores.csv |
7RXV-MTA | data/7R/7RXV-MTA/7RXV-MTA_ligand.pdbqt | data/7R/7RXV-MTA/7RXV-MTA_target.pdbqt | data/7R/7RXV-MTA/7RXV-MTA_decoys.pdbqt | data/7R/7RXV-MTA/7RXV-MTA_decoy_scores.csv |
7RUW-7RR | data/7R/7RUW-7RR/7RUW-7RR_ligand.pdbqt | data/7R/7RUW-7RR/7RUW-7RR_target.pdbqt | data/7R/7RUW-7RR/7RUW-7RR_decoys.pdbqt | data/7R/7RUW-7RR/7RUW-7RR_decoy_scores.csv |
7R41-GTP | data/7R/7R41-GTP/7R41-GTP_ligand.pdbqt | data/7R/7R41-GTP/7R41-GTP_target.pdbqt | data/7R/7R41-GTP/7R41-GTP_decoys.pdbqt | data/7R/7R41-GTP/7R41-GTP_decoy_scores.csv |
7R2C-BGC | data/7R/7R2C-BGC/7R2C-BGC_ligand.pdbqt | data/7R/7R2C-BGC/7R2C-BGC_target.pdbqt | data/7R/7R2C-BGC/7R2C-BGC_decoys.pdbqt | data/7R/7R2C-BGC/7R2C-BGC_decoy_scores.csv |
7RLL-G3D | data/7R/7RLL-G3D/7RLL-G3D_ligand.pdbqt | data/7R/7RLL-G3D/7RLL-G3D_target.pdbqt | data/7R/7RLL-G3D/7RLL-G3D_decoys.pdbqt | data/7R/7RLL-G3D/7RLL-G3D_decoy_scores.csv |
7RT4-7IZ | data/7R/7RT4-7IZ/7RT4-7IZ_ligand.pdbqt | data/7R/7RT4-7IZ/7RT4-7IZ_target.pdbqt | data/7R/7RT4-7IZ/7RT4-7IZ_decoys.pdbqt | data/7R/7RT4-7IZ/7RT4-7IZ_decoy_scores.csv |
7R46-GTP | data/7R/7R46-GTP/7R46-GTP_ligand.pdbqt | data/7R/7R46-GTP/7R46-GTP_target.pdbqt | data/7R/7R46-GTP/7R46-GTP_decoys.pdbqt | data/7R/7R46-GTP/7R46-GTP_decoy_scores.csv |
7R5B-P6G | data/7R/7R5B-P6G/7R5B-P6G_ligand.pdbqt | data/7R/7R5B-P6G/7R5B-P6G_target.pdbqt | data/7R/7R5B-P6G/7R5B-P6G_decoys.pdbqt | data/7R/7R5B-P6G/7R5B-P6G_decoy_scores.csv |
7RP4-MKZ | data/7R/7RP4-MKZ/7RP4-MKZ_ligand.pdbqt | data/7R/7RP4-MKZ/7RP4-MKZ_target.pdbqt | data/7R/7RP4-MKZ/7RP4-MKZ_decoys.pdbqt | data/7R/7RP4-MKZ/7RP4-MKZ_decoy_scores.csv |
7RW7-7UB | data/7R/7RW7-7UB/7RW7-7UB_ligand.pdbqt | data/7R/7RW7-7UB/7RW7-7UB_target.pdbqt | data/7R/7RW7-7UB/7RW7-7UB_decoys.pdbqt | data/7R/7RW7-7UB/7RW7-7UB_decoy_scores.csv |
7R4D-FMN | data/7R/7R4D-FMN/7R4D-FMN_ligand.pdbqt | data/7R/7R4D-FMN/7R4D-FMN_target.pdbqt | data/7R/7R4D-FMN/7R4D-FMN_decoys.pdbqt | data/7R/7R4D-FMN/7R4D-FMN_decoy_scores.csv |
7RV4-7SO | data/7R/7RV4-7SO/7RV4-7SO_ligand.pdbqt | data/7R/7RV4-7SO/7RV4-7SO_target.pdbqt | data/7R/7RV4-7SO/7RV4-7SO_decoys.pdbqt | data/7R/7RV4-7SO/7RV4-7SO_decoy_scores.csv |
7RRE-6IV | data/7R/7RRE-6IV/7RRE-6IV_ligand.pdbqt | data/7R/7RRE-6IV/7RRE-6IV_target.pdbqt | data/7R/7RRE-6IV/7RRE-6IV_decoys.pdbqt | data/7R/7RRE-6IV/7RRE-6IV_decoy_scores.csv |
7R2F-I1X | data/7R/7R2F-I1X/7R2F-I1X_ligand.pdbqt | data/7R/7R2F-I1X/7R2F-I1X_target.pdbqt | data/7R/7R2F-I1X/7R2F-I1X_decoys.pdbqt | data/7R/7R2F-I1X/7R2F-I1X_decoy_scores.csv |
7RCZ-ZZ7 | data/7R/7RCZ-ZZ7/7RCZ-ZZ7_ligand.pdbqt | data/7R/7RCZ-ZZ7/7RCZ-ZZ7_target.pdbqt | data/7R/7RCZ-ZZ7/7RCZ-ZZ7_decoys.pdbqt | data/7R/7RCZ-ZZ7/7RCZ-ZZ7_decoy_scores.csv |
7R45-FMN | data/7R/7R45-FMN/7R45-FMN_ligand.pdbqt | data/7R/7R45-FMN/7R45-FMN_target.pdbqt | data/7R/7R45-FMN/7R45-FMN_decoys.pdbqt | data/7R/7R45-FMN/7R45-FMN_decoy_scores.csv |
7RUY-7S0 | data/7R/7RUY-7S0/7RUY-7S0_ligand.pdbqt | data/7R/7RUY-7S0/7RUY-7S0_target.pdbqt | data/7R/7RUY-7S0/7RUY-7S0_decoys.pdbqt | data/7R/7RUY-7S0/7RUY-7S0_decoy_scores.csv |
7R0N-H40 | data/7R/7R0N-H40/7R0N-H40_ligand.pdbqt | data/7R/7R0N-H40/7R0N-H40_target.pdbqt | data/7R/7R0N-H40/7R0N-H40_decoys.pdbqt | data/7R/7R0N-H40/7R0N-H40_decoy_scores.csv |
7RW0-7YZ | data/7R/7RW0-7YZ/7RW0-7YZ_ligand.pdbqt | data/7R/7RW0-7YZ/7RW0-7YZ_target.pdbqt | data/7R/7RW0-7YZ/7RW0-7YZ_decoys.pdbqt | data/7R/7RW0-7YZ/7RW0-7YZ_decoy_scores.csv |
7RWH-SAM | data/7R/7RWH-SAM/7RWH-SAM_ligand.pdbqt | data/7R/7RWH-SAM/7RWH-SAM_target.pdbqt | data/7R/7RWH-SAM/7RWH-SAM_decoys.pdbqt | data/7R/7RWH-SAM/7RWH-SAM_decoy_scores.csv |
7R5W-I5Z | data/7R/7R5W-I5Z/7R5W-I5Z_ligand.pdbqt | data/7R/7R5W-I5Z/7R5W-I5Z_target.pdbqt | data/7R/7R5W-I5Z/7R5W-I5Z_decoys.pdbqt | data/7R/7R5W-I5Z/7R5W-I5Z_decoy_scores.csv |
7RS3-TYR | data/7R/7RS3-TYR/7RS3-TYR_ligand.pdbqt | data/7R/7RS3-TYR/7RS3-TYR_target.pdbqt | data/7R/7RS3-TYR/7RS3-TYR_decoys.pdbqt | data/7R/7RS3-TYR/7RS3-TYR_decoy_scores.csv |
7R4F-I49 | data/7R/7R4F-I49/7R4F-I49_ligand.pdbqt | data/7R/7R4F-I49/7R4F-I49_target.pdbqt | data/7R/7R4F-I49/7R4F-I49_decoys.pdbqt | data/7R/7R4F-I49/7R4F-I49_decoy_scores.csv |
7R44-EHZ | data/7R/7R44-EHZ/7R44-EHZ_ligand.pdbqt | data/7R/7R44-EHZ/7R44-EHZ_target.pdbqt | data/7R/7R44-EHZ/7R44-EHZ_decoys.pdbqt | data/7R/7R44-EHZ/7R44-EHZ_decoy_scores.csv |
7RIE-5IF | data/7R/7RIE-5IF/7RIE-5IF_ligand.pdbqt | data/7R/7RIE-5IF/7RIE-5IF_target.pdbqt | data/7R/7RIE-5IF/7RIE-5IF_decoys.pdbqt | data/7R/7RIE-5IF/7RIE-5IF_decoy_scores.csv |
7R48-I49 | data/7R/7R48-I49/7R48-I49_ligand.pdbqt | data/7R/7R48-I49/7R48-I49_target.pdbqt | data/7R/7R48-I49/7R48-I49_decoys.pdbqt | data/7R/7R48-I49/7R48-I49_decoy_scores.csv |
7RVP-7VQ | data/7R/7RVP-7VQ/7RVP-7VQ_ligand.pdbqt | data/7R/7RVP-7VQ/7RVP-7VQ_target.pdbqt | data/7R/7RVP-7VQ/7RVP-7VQ_decoys.pdbqt | data/7R/7RVP-7VQ/7RVP-7VQ_decoy_scores.csv |
7R2O-FMN | data/7R/7R2O-FMN/7R2O-FMN_ligand.pdbqt | data/7R/7R2O-FMN/7R2O-FMN_target.pdbqt | data/7R/7R2O-FMN/7R2O-FMN_decoys.pdbqt | data/7R/7R2O-FMN/7R2O-FMN_decoy_scores.csv |
7RV9-7SZ | data/7R/7RV9-7SZ/7RV9-7SZ_ligand.pdbqt | data/7R/7RV9-7SZ/7RV9-7SZ_target.pdbqt | data/7R/7RV9-7SZ/7RV9-7SZ_decoys.pdbqt | data/7R/7RV9-7SZ/7RV9-7SZ_decoy_scores.csv |
7RMZ-5ZJ | data/7R/7RMZ-5ZJ/7RMZ-5ZJ_ligand.pdbqt | data/7R/7RMZ-5ZJ/7RMZ-5ZJ_target.pdbqt | data/7R/7RMZ-5ZJ/7RMZ-5ZJ_decoys.pdbqt | data/7R/7RMZ-5ZJ/7RMZ-5ZJ_decoy_scores.csv |
7RCV-RRX | data/7R/7RCV-RRX/7RCV-RRX_ligand.pdbqt | data/7R/7RCV-RRX/7RCV-RRX_target.pdbqt | data/7R/7RCV-RRX/7RCV-RRX_decoys.pdbqt | data/7R/7RCV-RRX/7RCV-RRX_decoy_scores.csv |
7RPF-4J6 | data/7R/7RPF-4J6/7RPF-4J6_ligand.pdbqt | data/7R/7RPF-4J6/7RPF-4J6_target.pdbqt | data/7R/7RPF-4J6/7RPF-4J6_decoys.pdbqt | data/7R/7RPF-4J6/7RPF-4J6_decoy_scores.csv |
7R7E-AMP | data/7R/7R7E-AMP/7R7E-AMP_ligand.pdbqt | data/7R/7R7E-AMP/7R7E-AMP_target.pdbqt | data/7R/7R7E-AMP/7R7E-AMP_decoys.pdbqt | data/7R/7R7E-AMP/7R7E-AMP_decoy_scores.csv |
7R48-FMN | data/7R/7R48-FMN/7R48-FMN_ligand.pdbqt | data/7R/7R48-FMN/7R48-FMN_target.pdbqt | data/7R/7R48-FMN/7R48-FMN_decoys.pdbqt | data/7R/7R48-FMN/7R48-FMN_decoy_scores.csv |
7R0S-V55 | data/7R/7R0S-V55/7R0S-V55_ligand.pdbqt | data/7R/7R0S-V55/7R0S-V55_target.pdbqt | data/7R/7R0S-V55/7R0S-V55_decoys.pdbqt | data/7R/7R0S-V55/7R0S-V55_decoy_scores.csv |
7R1U-4IK | data/7R/7R1U-4IK/7R1U-4IK_ligand.pdbqt | data/7R/7R1U-4IK/7R1U-4IK_target.pdbqt | data/7R/7R1U-4IK/7R1U-4IK_decoys.pdbqt | data/7R/7R1U-4IK/7R1U-4IK_decoy_scores.csv |
7RAE-DHT | data/7R/7RAE-DHT/7RAE-DHT_ligand.pdbqt | data/7R/7RAE-DHT/7RAE-DHT_target.pdbqt | data/7R/7RAE-DHT/7RAE-DHT_decoys.pdbqt | data/7R/7RAE-DHT/7RAE-DHT_decoy_scores.csv |
7R39-ADN | data/7R/7R39-ADN/7R39-ADN_ligand.pdbqt | data/7R/7R39-ADN/7R39-ADN_target.pdbqt | data/7R/7R39-ADN/7R39-ADN_decoys.pdbqt | data/7R/7R39-ADN/7R39-ADN_decoy_scores.csv |
7RV5-7RB | data/7R/7RV5-7RB/7RV5-7RB_ligand.pdbqt | data/7R/7RV5-7RB/7RV5-7RB_target.pdbqt | data/7R/7RV5-7RB/7RV5-7RB_decoys.pdbqt | data/7R/7RV5-7RB/7RV5-7RB_decoy_scores.csv |
7RMT-5ZN | data/7R/7RMT-5ZN/7RMT-5ZN_ligand.pdbqt | data/7R/7RMT-5ZN/7RMT-5ZN_target.pdbqt | data/7R/7RMT-5ZN/7RMT-5ZN_decoys.pdbqt | data/7R/7RMT-5ZN/7RMT-5ZN_decoy_scores.csv |
7R48-LMT | data/7R/7R48-LMT/7R48-LMT_ligand.pdbqt | data/7R/7R48-LMT/7R48-LMT_target.pdbqt | data/7R/7R48-LMT/7R48-LMT_decoys.pdbqt | data/7R/7R48-LMT/7R48-LMT_decoy_scores.csv |
7R9P-2WI | data/7R/7R9P-2WI/7R9P-2WI_ligand.pdbqt | data/7R/7R9P-2WI/7R9P-2WI_target.pdbqt | data/7R/7R9P-2WI/7R9P-2WI_decoys.pdbqt | data/7R/7R9P-2WI/7R9P-2WI_decoy_scores.csv |
7RMD-5Z0 | data/7R/7RMD-5Z0/7RMD-5Z0_ligand.pdbqt | data/7R/7RMD-5Z0/7RMD-5Z0_target.pdbqt | data/7R/7RMD-5Z0/7RMD-5Z0_decoys.pdbqt | data/7R/7RMD-5Z0/7RMD-5Z0_decoy_scores.csv |
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