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 ⌀ |
|---|---|---|---|---|
5RFV-T8J | data/5R/5RFV-T8J/5RFV-T8J_ligand.pdbqt | data/5R/5RFV-T8J/5RFV-T8J_target.pdbqt | data/5R/5RFV-T8J/5RFV-T8J_decoys.pdbqt | data/5R/5RFV-T8J/5RFV-T8J_decoy_scores.csv |
5RKE-K2G | data/5R/5RKE-K2G/5RKE-K2G_ligand.pdbqt | data/5R/5RKE-K2G/5RKE-K2G_target.pdbqt | data/5R/5RKE-K2G/5RKE-K2G_decoys.pdbqt | data/5R/5RKE-K2G/5RKE-K2G_decoy_scores.csv |
5R0L-TBJ | data/5R/5R0L-TBJ/5R0L-TBJ_ligand.pdbqt | data/5R/5R0L-TBJ/5R0L-TBJ_target.pdbqt | data/5R/5R0L-TBJ/5R0L-TBJ_decoys.pdbqt | data/5R/5R0L-TBJ/5R0L-TBJ_decoy_scores.csv |
5R1W-R8Y | data/5R/5R1W-R8Y/5R1W-R8Y_ligand.pdbqt | data/5R/5R1W-R8Y/5R1W-R8Y_target.pdbqt | data/5R/5R1W-R8Y/5R1W-R8Y_decoys.pdbqt | data/5R/5R1W-R8Y/5R1W-R8Y_decoy_scores.csv |
5RZ8-WHG | data/5R/5RZ8-WHG/5RZ8-WHG_ligand.pdbqt | data/5R/5RZ8-WHG/5RZ8-WHG_target.pdbqt | data/5R/5RZ8-WHG/5RZ8-WHG_decoys.pdbqt | data/5R/5RZ8-WHG/5RZ8-WHG_decoy_scores.csv |
5RWK-WN4 | data/5R/5RWK-WN4/5RWK-WN4_ligand.pdbqt | data/5R/5RWK-WN4/5RWK-WN4_target.pdbqt | data/5R/5RWK-WN4/5RWK-WN4_decoys.pdbqt | data/5R/5RWK-WN4/5RWK-WN4_decoy_scores.csv |
5RLT-UVJ | data/5R/5RLT-UVJ/5RLT-UVJ_ligand.pdbqt | data/5R/5RLT-UVJ/5RLT-UVJ_target.pdbqt | data/5R/5RLT-UVJ/5RLT-UVJ_decoys.pdbqt | data/5R/5RLT-UVJ/5RLT-UVJ_decoy_scores.csv |
5RZH-NZD | data/5R/5RZH-NZD/5RZH-NZD_ligand.pdbqt | data/5R/5RZH-NZD/5RZH-NZD_target.pdbqt | data/5R/5RZH-NZD/5RZH-NZD_decoys.pdbqt | data/5R/5RZH-NZD/5RZH-NZD_decoy_scores.csv |
5RMJ-JOV | data/5R/5RMJ-JOV/5RMJ-JOV_ligand.pdbqt | data/5R/5RMJ-JOV/5RMJ-JOV_target.pdbqt | data/5R/5RMJ-JOV/5RMJ-JOV_decoys.pdbqt | data/5R/5RMJ-JOV/5RMJ-JOV_decoy_scores.csv |
5RWN-U0V | data/5R/5RWN-U0V/5RWN-U0V_ligand.pdbqt | data/5R/5RWN-U0V/5RWN-U0V_target.pdbqt | data/5R/5RWN-U0V/5RWN-U0V_decoys.pdbqt | data/5R/5RWN-U0V/5RWN-U0V_decoy_scores.csv |
5RX3-WNJ | data/5R/5RX3-WNJ/5RX3-WNJ_ligand.pdbqt | data/5R/5RX3-WNJ/5RX3-WNJ_target.pdbqt | data/5R/5RX3-WNJ/5RX3-WNJ_decoys.pdbqt | data/5R/5RX3-WNJ/5RX3-WNJ_decoy_scores.csv |
5RGE-6NT | data/5R/5RGE-6NT/5RGE-6NT_ligand.pdbqt | data/5R/5RGE-6NT/5RGE-6NT_target.pdbqt | data/5R/5RGE-6NT/5RGE-6NT_decoys.pdbqt | data/5R/5RGE-6NT/5RGE-6NT_decoy_scores.csv |
5REP-T3G | data/5R/5REP-T3G/5REP-T3G_ligand.pdbqt | data/5R/5REP-T3G/5REP-T3G_target.pdbqt | data/5R/5REP-T3G/5REP-T3G_decoys.pdbqt | data/5R/5REP-T3G/5REP-T3G_decoy_scores.csv |
5RAU-HGE | data/5R/5RAU-HGE/5RAU-HGE_ligand.pdbqt | data/5R/5RAU-HGE/5RAU-HGE_target.pdbqt | data/5R/5RAU-HGE/5RAU-HGE_decoys.pdbqt | data/5R/5RAU-HGE/5RAU-HGE_decoy_scores.csv |
5RSM-4SO | data/5R/5RSM-4SO/5RSM-4SO_ligand.pdbqt | data/5R/5RSM-4SO/5RSM-4SO_target.pdbqt | data/5R/5RSM-4SO/5RSM-4SO_decoys.pdbqt | data/5R/5RSM-4SO/5RSM-4SO_decoy_scores.csv |
5RZT-WJA | data/5R/5RZT-WJA/5RZT-WJA_ligand.pdbqt | data/5R/5RZT-WJA/5RZT-WJA_target.pdbqt | data/5R/5RZT-WJA/5RZT-WJA_decoys.pdbqt | data/5R/5RZT-WJA/5RZT-WJA_decoy_scores.csv |
5RY4-O0P | data/5R/5RY4-O0P/5RY4-O0P_ligand.pdbqt | data/5R/5RY4-O0P/5RY4-O0P_target.pdbqt | data/5R/5RY4-O0P/5RY4-O0P_decoys.pdbqt | data/5R/5RY4-O0P/5RY4-O0P_decoy_scores.csv |
5R54-RYM | data/5R/5R54-RYM/5R54-RYM_ligand.pdbqt | data/5R/5R54-RYM/5R54-RYM_target.pdbqt | data/5R/5R54-RYM/5R54-RYM_decoys.pdbqt | data/5R/5R54-RYM/5R54-RYM_decoy_scores.csv |
5RM2-UXG | data/5R/5RM2-UXG/5RM2-UXG_ligand.pdbqt | data/5R/5RM2-UXG/5RM2-UXG_target.pdbqt | data/5R/5RM2-UXG/5RM2-UXG_decoys.pdbqt | data/5R/5RM2-UXG/5RM2-UXG_decoy_scores.csv |
5RXU-WKJ | data/5R/5RXU-WKJ/5RXU-WKJ_ligand.pdbqt | data/5R/5RXU-WKJ/5RXU-WKJ_target.pdbqt | data/5R/5RXU-WKJ/5RXU-WKJ_decoys.pdbqt | data/5R/5RXU-WKJ/5RXU-WKJ_decoy_scores.csv |
5RLG-VW1 | data/5R/5RLG-VW1/5RLG-VW1_ligand.pdbqt | data/5R/5RLG-VW1/5RLG-VW1_target.pdbqt | data/5R/5RLG-VW1/5RLG-VW1_decoys.pdbqt | data/5R/5RLG-VW1/5RLG-VW1_decoy_scores.csv |
5R5H-JOV | data/5R/5R5H-JOV/5R5H-JOV_ligand.pdbqt | data/5R/5R5H-JOV/5R5H-JOV_target.pdbqt | data/5R/5R5H-JOV/5R5H-JOV_decoys.pdbqt | data/5R/5R5H-JOV/5R5H-JOV_decoy_scores.csv |
5R64-M0J | data/5R/5R64-M0J/5R64-M0J_ligand.pdbqt | data/5R/5R64-M0J/5R64-M0J_target.pdbqt | data/5R/5R64-M0J/5R64-M0J_decoys.pdbqt | data/5R/5R64-M0J/5R64-M0J_decoy_scores.csv |
5R5G-S1M | data/5R/5R5G-S1M/5R5G-S1M_ligand.pdbqt | data/5R/5R5G-S1M/5R5G-S1M_target.pdbqt | data/5R/5R5G-S1M/5R5G-S1M_decoys.pdbqt | data/5R/5R5G-S1M/5R5G-S1M_decoy_scores.csv |
5RF0-T5D | data/5R/5RF0-T5D/5RF0-T5D_ligand.pdbqt | data/5R/5RF0-T5D/5RF0-T5D_target.pdbqt | data/5R/5RF0-T5D/5RF0-T5D_decoys.pdbqt | data/5R/5RF0-T5D/5RF0-T5D_decoy_scores.csv |
5RYB-WKM | data/5R/5RYB-WKM/5RYB-WKM_ligand.pdbqt | data/5R/5RYB-WKM/5RYB-WKM_target.pdbqt | data/5R/5RYB-WKM/5RYB-WKM_decoys.pdbqt | data/5R/5RYB-WKM/5RYB-WKM_decoy_scores.csv |
5R81-RZJ | data/5R/5R81-RZJ/5R81-RZJ_ligand.pdbqt | data/5R/5R81-RZJ/5R81-RZJ_target.pdbqt | data/5R/5R81-RZJ/5R81-RZJ_decoys.pdbqt | data/5R/5R81-RZJ/5R81-RZJ_decoy_scores.csv |
5RLW-S9S | data/5R/5RLW-S9S/5RLW-S9S_ligand.pdbqt | data/5R/5RLW-S9S/5RLW-S9S_target.pdbqt | data/5R/5RLW-S9S/5RLW-S9S_decoys.pdbqt | data/5R/5RLW-S9S/5RLW-S9S_decoy_scores.csv |
5RKX-UR1 | data/5R/5RKX-UR1/5RKX-UR1_ligand.pdbqt | data/5R/5RKX-UR1/5RKX-UR1_target.pdbqt | data/5R/5RKX-UR1/5RKX-UR1_decoys.pdbqt | data/5R/5RKX-UR1/5RKX-UR1_decoy_scores.csv |
5REZ-T54 | data/5R/5REZ-T54/5REZ-T54_ligand.pdbqt | data/5R/5REZ-T54/5REZ-T54_target.pdbqt | data/5R/5REZ-T54/5REZ-T54_decoys.pdbqt | data/5R/5REZ-T54/5REZ-T54_decoy_scores.csv |
5RA3-SVD | data/5R/5RA3-SVD/5RA3-SVD_ligand.pdbqt | data/5R/5RA3-SVD/5RA3-SVD_target.pdbqt | data/5R/5RA3-SVD/5RA3-SVD_decoys.pdbqt | data/5R/5RA3-SVD/5RA3-SVD_decoy_scores.csv |
5RTA-Q6T | data/5R/5RTA-Q6T/5RTA-Q6T_ligand.pdbqt | data/5R/5RTA-Q6T/5RTA-Q6T_target.pdbqt | data/5R/5RTA-Q6T/5RTA-Q6T_decoys.pdbqt | data/5R/5RTA-Q6T/5RTA-Q6T_decoy_scores.csv |
5RUZ-W6S | data/5R/5RUZ-W6S/5RUZ-W6S_ligand.pdbqt | data/5R/5RUZ-W6S/5RUZ-W6S_target.pdbqt | data/5R/5RUZ-W6S/5RUZ-W6S_decoys.pdbqt | data/5R/5RUZ-W6S/5RUZ-W6S_decoy_scores.csv |
5RSD-1LQ | data/5R/5RSD-1LQ/5RSD-1LQ_ligand.pdbqt | data/5R/5RSD-1LQ/5RSD-1LQ_target.pdbqt | data/5R/5RSD-1LQ/5RSD-1LQ_decoys.pdbqt | data/5R/5RSD-1LQ/5RSD-1LQ_decoy_scores.csv |
5RTE-4FL | data/5R/5RTE-4FL/5RTE-4FL_ligand.pdbqt | data/5R/5RTE-4FL/5RTE-4FL_target.pdbqt | data/5R/5RTE-4FL/5RTE-4FL_decoys.pdbqt | data/5R/5RTE-4FL/5RTE-4FL_decoy_scores.csv |
5RXM-GWV | data/5R/5RXM-GWV/5RXM-GWV_ligand.pdbqt | data/5R/5RXM-GWV/5RXM-GWV_target.pdbqt | data/5R/5RXM-GWV/5RXM-GWV_decoys.pdbqt | data/5R/5RXM-GWV/5RXM-GWV_decoy_scores.csv |
5RZX-O0Y | data/5R/5RZX-O0Y/5RZX-O0Y_ligand.pdbqt | data/5R/5RZX-O0Y/5RZX-O0Y_target.pdbqt | data/5R/5RZX-O0Y/5RZX-O0Y_decoys.pdbqt | data/5R/5RZX-O0Y/5RZX-O0Y_decoy_scores.csv |
5RE6-O0S | data/5R/5RE6-O0S/5RE6-O0S_ligand.pdbqt | data/5R/5RE6-O0S/5RE6-O0S_target.pdbqt | data/5R/5RE6-O0S/5RE6-O0S_decoys.pdbqt | data/5R/5RE6-O0S/5RE6-O0S_decoy_scores.csv |
5RSN-51X | data/5R/5RSN-51X/5RSN-51X_ligand.pdbqt | data/5R/5RSN-51X/5RSN-51X_target.pdbqt | data/5R/5RSN-51X/5RSN-51X_decoys.pdbqt | data/5R/5RSN-51X/5RSN-51X_decoy_scores.csv |
5RK9-UVG | data/5R/5RK9-UVG/5RK9-UVG_ligand.pdbqt | data/5R/5RK9-UVG/5RK9-UVG_target.pdbqt | data/5R/5RK9-UVG/5RK9-UVG_decoys.pdbqt | data/5R/5RK9-UVG/5RK9-UVG_decoy_scores.csv |
5RYI-NZ4 | data/5R/5RYI-NZ4/5RYI-NZ4_ligand.pdbqt | data/5R/5RYI-NZ4/5RYI-NZ4_target.pdbqt | data/5R/5RYI-NZ4/5RYI-NZ4_decoys.pdbqt | data/5R/5RYI-NZ4/5RYI-NZ4_decoy_scores.csv |
5RTT-NMI | data/5R/5RTT-NMI/5RTT-NMI_ligand.pdbqt | data/5R/5RTT-NMI/5RTT-NMI_target.pdbqt | data/5R/5RTT-NMI/5RTT-NMI_decoys.pdbqt | data/5R/5RTT-NMI/5RTT-NMI_decoy_scores.csv |
5RB3-MPV | data/5R/5RB3-MPV/5RB3-MPV_ligand.pdbqt | data/5R/5RB3-MPV/5RB3-MPV_target.pdbqt | data/5R/5RB3-MPV/5RB3-MPV_decoys.pdbqt | data/5R/5RB3-MPV/5RB3-MPV_decoy_scores.csv |
5RYR-WGP | data/5R/5RYR-WGP/5RYR-WGP_ligand.pdbqt | data/5R/5RYR-WGP/5RYR-WGP_target.pdbqt | data/5R/5RYR-WGP/5RYR-WGP_decoys.pdbqt | data/5R/5RYR-WGP/5RYR-WGP_decoy_scores.csv |
5R1V-R8S | data/5R/5R1V-R8S/5R1V-R8S_ligand.pdbqt | data/5R/5R1V-R8S/5R1V-R8S_target.pdbqt | data/5R/5R1V-R8S/5R1V-R8S_decoys.pdbqt | data/5R/5R1V-R8S/5R1V-R8S_decoy_scores.csv |
5RYY-WGV | data/5R/5RYY-WGV/5RYY-WGV_ligand.pdbqt | data/5R/5RYY-WGV/5RYY-WGV_target.pdbqt | data/5R/5RYY-WGV/5RYY-WGV_decoys.pdbqt | data/5R/5RYY-WGV/5RYY-WGV_decoy_scores.csv |
5RA6-SVM | data/5R/5RA6-SVM/5RA6-SVM_ligand.pdbqt | data/5R/5RA6-SVM/5RA6-SVM_target.pdbqt | data/5R/5RA6-SVM/5RA6-SVM_decoys.pdbqt | data/5R/5RA6-SVM/5RA6-SVM_decoy_scores.csv |
5RM8-GQJ | data/5R/5RM8-GQJ/5RM8-GQJ_ligand.pdbqt | data/5R/5RM8-GQJ/5RM8-GQJ_target.pdbqt | data/5R/5RM8-GQJ/5RM8-GQJ_decoys.pdbqt | data/5R/5RM8-GQJ/5RM8-GQJ_decoy_scores.csv |
5RMA-JHJ | data/5R/5RMA-JHJ/5RMA-JHJ_ligand.pdbqt | data/5R/5RMA-JHJ/5RMA-JHJ_target.pdbqt | data/5R/5RMA-JHJ/5RMA-JHJ_decoys.pdbqt | data/5R/5RMA-JHJ/5RMA-JHJ_decoy_scores.csv |
5RZ3-WH4 | data/5R/5RZ3-WH4/5RZ3-WH4_ligand.pdbqt | data/5R/5RZ3-WH4/5RZ3-WH4_target.pdbqt | data/5R/5RZ3-WH4/5RZ3-WH4_decoys.pdbqt | data/5R/5RZ3-WH4/5RZ3-WH4_decoy_scores.csv |
5RYL-S7J | data/5R/5RYL-S7J/5RYL-S7J_ligand.pdbqt | data/5R/5RYL-S7J/5RYL-S7J_target.pdbqt | data/5R/5RYL-S7J/5RYL-S7J_decoys.pdbqt | data/5R/5RYL-S7J/5RYL-S7J_decoy_scores.csv |
5RH6-UHY | data/5R/5RH6-UHY/5RH6-UHY_ligand.pdbqt | data/5R/5RH6-UHY/5RH6-UHY_target.pdbqt | data/5R/5RH6-UHY/5RH6-UHY_decoys.pdbqt | data/5R/5RH6-UHY/5RH6-UHY_decoy_scores.csv |
5RHX-UR1 | data/5R/5RHX-UR1/5RHX-UR1_ligand.pdbqt | data/5R/5RHX-UR1/5RHX-UR1_target.pdbqt | data/5R/5RHX-UR1/5RHX-UR1_decoys.pdbqt | data/5R/5RHX-UR1/5RHX-UR1_decoy_scores.csv |
5RLO-UQS | data/5R/5RLO-UQS/5RLO-UQS_ligand.pdbqt | data/5R/5RLO-UQS/5RLO-UQS_target.pdbqt | data/5R/5RLO-UQS/5RLO-UQS_decoys.pdbqt | data/5R/5RLO-UQS/5RLO-UQS_decoy_scores.csv |
5RAW-JJ7 | data/5R/5RAW-JJ7/5RAW-JJ7_ligand.pdbqt | data/5R/5RAW-JJ7/5RAW-JJ7_target.pdbqt | data/5R/5RAW-JJ7/5RAW-JJ7_decoys.pdbqt | data/5R/5RAW-JJ7/5RAW-JJ7_decoy_scores.csv |
5RV3-MYI | data/5R/5RV3-MYI/5RV3-MYI_ligand.pdbqt | data/5R/5RV3-MYI/5RV3-MYI_target.pdbqt | data/5R/5RV3-MYI/5RV3-MYI_decoys.pdbqt | data/5R/5RV3-MYI/5RV3-MYI_decoy_scores.csv |
5RYO-NU4 | data/5R/5RYO-NU4/5RYO-NU4_ligand.pdbqt | data/5R/5RYO-NU4/5RYO-NU4_target.pdbqt | data/5R/5RYO-NU4/5RYO-NU4_decoys.pdbqt | data/5R/5RYO-NU4/5RYO-NU4_decoy_scores.csv |
5RAI-S3M | data/5R/5RAI-S3M/5RAI-S3M_ligand.pdbqt | data/5R/5RAI-S3M/5RAI-S3M_target.pdbqt | data/5R/5RAI-S3M/5RAI-S3M_decoys.pdbqt | data/5R/5RAI-S3M/5RAI-S3M_decoy_scores.csv |
5RAR-S9D | data/5R/5RAR-S9D/5RAR-S9D_ligand.pdbqt | data/5R/5RAR-S9D/5RAR-S9D_target.pdbqt | data/5R/5RAR-S9D/5RAR-S9D_decoys.pdbqt | data/5R/5RAR-S9D/5RAR-S9D_decoy_scores.csv |
5RST-5HN | data/5R/5RST-5HN/5RST-5HN_ligand.pdbqt | data/5R/5RST-5HN/5RST-5HN_target.pdbqt | data/5R/5RST-5HN/5RST-5HN_decoys.pdbqt | data/5R/5RST-5HN/5RST-5HN_decoy_scores.csv |
5RXD-WNP | data/5R/5RXD-WNP/5RXD-WNP_ligand.pdbqt | data/5R/5RXD-WNP/5RXD-WNP_target.pdbqt | data/5R/5RXD-WNP/5RXD-WNP_decoys.pdbqt | data/5R/5RXD-WNP/5RXD-WNP_decoy_scores.csv |
5RAA-S3Y | data/5R/5RAA-S3Y/5RAA-S3Y_ligand.pdbqt | data/5R/5RAA-S3Y/5RAA-S3Y_target.pdbqt | data/5R/5RAA-S3Y/5RAA-S3Y_decoys.pdbqt | data/5R/5RAA-S3Y/5RAA-S3Y_decoy_scores.csv |
5R9J-LXS | data/5R/5R9J-LXS/5R9J-LXS_ligand.pdbqt | data/5R/5R9J-LXS/5R9J-LXS_target.pdbqt | data/5R/5R9J-LXS/5R9J-LXS_decoys.pdbqt | data/5R/5R9J-LXS/5R9J-LXS_decoy_scores.csv |
5R5C-GQP | data/5R/5R5C-GQP/5R5C-GQP_ligand.pdbqt | data/5R/5R5C-GQP/5R5C-GQP_target.pdbqt | data/5R/5R5C-GQP/5R5C-GQP_decoys.pdbqt | data/5R/5R5C-GQP/5R5C-GQP_decoy_scores.csv |
5RFC-K1Y | data/5R/5RFC-K1Y/5RFC-K1Y_ligand.pdbqt | data/5R/5RFC-K1Y/5RFC-K1Y_target.pdbqt | data/5R/5RFC-K1Y/5RFC-K1Y_decoys.pdbqt | data/5R/5RFC-K1Y/5RFC-K1Y_decoy_scores.csv |
5RZJ-7ZC | data/5R/5RZJ-7ZC/5RZJ-7ZC_ligand.pdbqt | data/5R/5RZJ-7ZC/5RZJ-7ZC_target.pdbqt | data/5R/5RZJ-7ZC/5RZJ-7ZC_decoys.pdbqt | data/5R/5RZJ-7ZC/5RZJ-7ZC_decoy_scores.csv |
5R62-RXJ | data/5R/5R62-RXJ/5R62-RXJ_ligand.pdbqt | data/5R/5R62-RXJ/5R62-RXJ_target.pdbqt | data/5R/5R62-RXJ/5R62-RXJ_decoys.pdbqt | data/5R/5R62-RXJ/5R62-RXJ_decoy_scores.csv |
5RA8-2O6 | data/5R/5RA8-2O6/5RA8-2O6_ligand.pdbqt | data/5R/5RA8-2O6/5RA8-2O6_target.pdbqt | data/5R/5RA8-2O6/5RA8-2O6_decoys.pdbqt | data/5R/5RA8-2O6/5RA8-2O6_decoy_scores.csv |
5RTR-SHA | data/5R/5RTR-SHA/5RTR-SHA_ligand.pdbqt | data/5R/5RTR-SHA/5RTR-SHA_target.pdbqt | data/5R/5RTR-SHA/5RTR-SHA_decoys.pdbqt | data/5R/5RTR-SHA/5RTR-SHA_decoy_scores.csv |
5RKF-UVY | data/5R/5RKF-UVY/5RKF-UVY_ligand.pdbqt | data/5R/5RKF-UVY/5RKF-UVY_target.pdbqt | data/5R/5RKF-UVY/5RKF-UVY_decoys.pdbqt | data/5R/5RKF-UVY/5RKF-UVY_decoy_scores.csv |
5REL-T2G | data/5R/5REL-T2G/5REL-T2G_ligand.pdbqt | data/5R/5REL-T2G/5REL-T2G_target.pdbqt | data/5R/5REL-T2G/5REL-T2G_decoys.pdbqt | data/5R/5REL-T2G/5REL-T2G_decoy_scores.csv |
5RWJ-AXS | data/5R/5RWJ-AXS/5RWJ-AXS_ligand.pdbqt | data/5R/5RWJ-AXS/5RWJ-AXS_target.pdbqt | data/5R/5RWJ-AXS/5RWJ-AXS_decoys.pdbqt | data/5R/5RWJ-AXS/5RWJ-AXS_decoy_scores.csv |
5R58-S0S | data/5R/5R58-S0S/5R58-S0S_ligand.pdbqt | data/5R/5R58-S0S/5R58-S0S_target.pdbqt | data/5R/5R58-S0S/5R58-S0S_decoys.pdbqt | data/5R/5R58-S0S/5R58-S0S_decoy_scores.csv |
5RUF-54T | data/5R/5RUF-54T/5RUF-54T_ligand.pdbqt | data/5R/5RUF-54T/5RUF-54T_target.pdbqt | data/5R/5RUF-54T/5RUF-54T_decoys.pdbqt | data/5R/5RUF-54T/5RUF-54T_decoy_scores.csv |
5RFO-T7S | data/5R/5RFO-T7S/5RFO-T7S_ligand.pdbqt | data/5R/5RFO-T7S/5RFO-T7S_target.pdbqt | data/5R/5RFO-T7S/5RFO-T7S_decoys.pdbqt | data/5R/5RFO-T7S/5RFO-T7S_decoy_scores.csv |
5RL8-VVG | data/5R/5RL8-VVG/5RL8-VVG_ligand.pdbqt | data/5R/5RL8-VVG/5RL8-VVG_target.pdbqt | data/5R/5RL8-VVG/5RL8-VVG_decoys.pdbqt | data/5R/5RL8-VVG/5RL8-VVG_decoy_scores.csv |
5R29-RDM | data/5R/5R29-RDM/5R29-RDM_ligand.pdbqt | data/5R/5R29-RDM/5R29-RDM_target.pdbqt | data/5R/5R29-RDM/5R29-RDM_decoys.pdbqt | data/5R/5R29-RDM/5R29-RDM_decoy_scores.csv |
5RAY-S9M | data/5R/5RAY-S9M/5RAY-S9M_ligand.pdbqt | data/5R/5RAY-S9M/5RAY-S9M_target.pdbqt | data/5R/5RAY-S9M/5RAY-S9M_decoys.pdbqt | data/5R/5RAY-S9M/5RAY-S9M_decoy_scores.csv |
5RJR-S9S | data/5R/5RJR-S9S/5RJR-S9S_ligand.pdbqt | data/5R/5RJR-S9S/5RJR-S9S_target.pdbqt | data/5R/5RJR-S9S/5RJR-S9S_decoys.pdbqt | data/5R/5RJR-S9S/5RJR-S9S_decoy_scores.csv |
5RXL-WL7 | data/5R/5RXL-WL7/5RXL-WL7_ligand.pdbqt | data/5R/5RXL-WL7/5RXL-WL7_target.pdbqt | data/5R/5RXL-WL7/5RXL-WL7_decoys.pdbqt | data/5R/5RXL-WL7/5RXL-WL7_decoy_scores.csv |
5RKL-UWV | data/5R/5RKL-UWV/5RKL-UWV_ligand.pdbqt | data/5R/5RKL-UWV/5RKL-UWV_target.pdbqt | data/5R/5RKL-UWV/5RKL-UWV_decoys.pdbqt | data/5R/5RKL-UWV/5RKL-UWV_decoy_scores.csv |
5RGF-6NT | data/5R/5RGF-6NT/5RGF-6NT_ligand.pdbqt | data/5R/5RGF-6NT/5RGF-6NT_target.pdbqt | data/5R/5RGF-6NT/5RGF-6NT_decoys.pdbqt | data/5R/5RGF-6NT/5RGF-6NT_decoy_scores.csv |
5RWI-O3D | data/5R/5RWI-O3D/5RWI-O3D_ligand.pdbqt | data/5R/5RWI-O3D/5RWI-O3D_target.pdbqt | data/5R/5RWI-O3D/5RWI-O3D_decoys.pdbqt | data/5R/5RWI-O3D/5RWI-O3D_decoy_scores.csv |
5RXQ-WL4 | data/5R/5RXQ-WL4/5RXQ-WL4_ligand.pdbqt | data/5R/5RXQ-WL4/5RXQ-WL4_target.pdbqt | data/5R/5RXQ-WL4/5RXQ-WL4_decoys.pdbqt | data/5R/5RXQ-WL4/5RXQ-WL4_decoy_scores.csv |
5R0J-RBJ | data/5R/5R0J-RBJ/5R0J-RBJ_ligand.pdbqt | data/5R/5R0J-RBJ/5R0J-RBJ_target.pdbqt | data/5R/5R0J-RBJ/5R0J-RBJ_decoys.pdbqt | data/5R/5R0J-RBJ/5R0J-RBJ_decoy_scores.csv |
5RGA-6NT | data/5R/5RGA-6NT/5RGA-6NT_ligand.pdbqt | data/5R/5RGA-6NT/5RGA-6NT_target.pdbqt | data/5R/5RGA-6NT/5RGA-6NT_decoys.pdbqt | data/5R/5RGA-6NT/5RGA-6NT_decoy_scores.csv |
5RKU-UXA | data/5R/5RKU-UXA/5RKU-UXA_ligand.pdbqt | data/5R/5RKU-UXA/5RKU-UXA_target.pdbqt | data/5R/5RKU-UXA/5RKU-UXA_decoys.pdbqt | data/5R/5RKU-UXA/5RKU-UXA_decoy_scores.csv |
5R7Z-HWH | data/5R/5R7Z-HWH/5R7Z-HWH_ligand.pdbqt | data/5R/5R7Z-HWH/5R7Z-HWH_target.pdbqt | data/5R/5R7Z-HWH/5R7Z-HWH_decoys.pdbqt | data/5R/5R7Z-HWH/5R7Z-HWH_decoy_scores.csv |
5RLR-VWD | data/5R/5RLR-VWD/5RLR-VWD_ligand.pdbqt | data/5R/5RLR-VWD/5RLR-VWD_target.pdbqt | data/5R/5RLR-VWD/5RLR-VWD_decoys.pdbqt | data/5R/5RLR-VWD/5RLR-VWD_decoy_scores.csv |
5RXF-WLG | data/5R/5RXF-WLG/5RXF-WLG_ligand.pdbqt | data/5R/5RXF-WLG/5RXF-WLG_target.pdbqt | data/5R/5RXF-WLG/5RXF-WLG_decoys.pdbqt | data/5R/5RXF-WLG/5RXF-WLG_decoy_scores.csv |
5R20-R9V | data/5R/5R20-R9V/5R20-R9V_ligand.pdbqt | data/5R/5R20-R9V/5R20-R9V_target.pdbqt | data/5R/5R20-R9V/5R20-R9V_decoys.pdbqt | data/5R/5R20-R9V/5R20-R9V_decoy_scores.csv |
5R4Y-GX4 | data/5R/5R4Y-GX4/5R4Y-GX4_ligand.pdbqt | data/5R/5R4Y-GX4/5R4Y-GX4_target.pdbqt | data/5R/5R4Y-GX4/5R4Y-GX4_decoys.pdbqt | data/5R/5R4Y-GX4/5R4Y-GX4_decoy_scores.csv |
5RL4-VEV | data/5R/5RL4-VEV/5RL4-VEV_ligand.pdbqt | data/5R/5RL4-VEV/5RL4-VEV_target.pdbqt | data/5R/5RL4-VEV/5RL4-VEV_decoys.pdbqt | data/5R/5RL4-VEV/5RL4-VEV_decoy_scores.csv |
5RK8-UVJ | data/5R/5RK8-UVJ/5RK8-UVJ_ligand.pdbqt | data/5R/5RK8-UVJ/5RK8-UVJ_target.pdbqt | data/5R/5RK8-UVJ/5RK8-UVJ_decoys.pdbqt | data/5R/5RK8-UVJ/5RK8-UVJ_decoy_scores.csv |
5RXG-WLD | data/5R/5RXG-WLD/5RXG-WLD_ligand.pdbqt | data/5R/5RXG-WLD/5RXG-WLD_target.pdbqt | data/5R/5RXG-WLD/5RXG-WLD_decoys.pdbqt | data/5R/5RXG-WLD/5RXG-WLD_decoy_scores.csv |
5R4H-HWH | data/5R/5R4H-HWH/5R4H-HWH_ligand.pdbqt | data/5R/5R4H-HWH/5R4H-HWH_target.pdbqt | data/5R/5R4H-HWH/5R4H-HWH_decoys.pdbqt | data/5R/5R4H-HWH/5R4H-HWH_decoy_scores.csv |
5RXY-WNV | data/5R/5RXY-WNV/5RXY-WNV_ligand.pdbqt | data/5R/5RXY-WNV/5RXY-WNV_target.pdbqt | data/5R/5RXY-WNV/5RXY-WNV_decoys.pdbqt | data/5R/5RXY-WNV/5RXY-WNV_decoy_scores.csv |
5RX6-GX4 | data/5R/5RX6-GX4/5RX6-GX4_ligand.pdbqt | data/5R/5RX6-GX4/5RX6-GX4_target.pdbqt | data/5R/5RX6-GX4/5RX6-GX4_decoys.pdbqt | data/5R/5RX6-GX4/5RX6-GX4_decoy_scores.csv |
5RSS-NC3 | data/5R/5RSS-NC3/5RSS-NC3_ligand.pdbqt | data/5R/5RSS-NC3/5RSS-NC3_target.pdbqt | data/5R/5RSS-NC3/5RSS-NC3_decoys.pdbqt | data/5R/5RSS-NC3/5RSS-NC3_decoy_scores.csv |
5R4X-K3D | data/5R/5R4X-K3D/5R4X-K3D_ligand.pdbqt | data/5R/5R4X-K3D/5R4X-K3D_target.pdbqt | data/5R/5R4X-K3D/5R4X-K3D_decoys.pdbqt | data/5R/5R4X-K3D/5R4X-K3D_decoy_scores.csv |
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