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 ⌀ |
|---|---|---|---|---|
5REB-T0Y | data/5R/5REB-T0Y/5REB-T0Y_ligand.pdbqt | data/5R/5REB-T0Y/5REB-T0Y_target.pdbqt | data/5R/5REB-T0Y/5REB-T0Y_decoys.pdbqt | data/5R/5REB-T0Y/5REB-T0Y_decoy_scores.csv |
5RHW-GV1 | data/5R/5RHW-GV1/5RHW-GV1_ligand.pdbqt | data/5R/5RHW-GV1/5RHW-GV1_target.pdbqt | data/5R/5RHW-GV1/5RHW-GV1_decoys.pdbqt | data/5R/5RHW-GV1/5RHW-GV1_decoy_scores.csv |
5RHM-UQS | data/5R/5RHM-UQS/5RHM-UQS_ligand.pdbqt | data/5R/5RHM-UQS/5RHM-UQS_target.pdbqt | data/5R/5RHM-UQS/5RHM-UQS_decoys.pdbqt | data/5R/5RHM-UQS/5RHM-UQS_decoy_scores.csv |
5RY1-WO1 | data/5R/5RY1-WO1/5RY1-WO1_ligand.pdbqt | data/5R/5RY1-WO1/5RY1-WO1_target.pdbqt | data/5R/5RY1-WO1/5RY1-WO1_decoys.pdbqt | data/5R/5RY1-WO1/5RY1-WO1_decoy_scores.csv |
5RAO-S3S | data/5R/5RAO-S3S/5RAO-S3S_ligand.pdbqt | data/5R/5RAO-S3S/5RAO-S3S_target.pdbqt | data/5R/5RAO-S3S/5RAO-S3S_decoys.pdbqt | data/5R/5RAO-S3S/5RAO-S3S_decoy_scores.csv |
5RA5-SVJ | data/5R/5RA5-SVJ/5RA5-SVJ_ligand.pdbqt | data/5R/5RA5-SVJ/5RA5-SVJ_target.pdbqt | data/5R/5RA5-SVJ/5RA5-SVJ_decoys.pdbqt | data/5R/5RA5-SVJ/5RA5-SVJ_decoy_scores.csv |
5RVC-W7V | data/5R/5RVC-W7V/5RVC-W7V_ligand.pdbqt | data/5R/5RVC-W7V/5RVC-W7V_target.pdbqt | data/5R/5RVC-W7V/5RVC-W7V_decoys.pdbqt | data/5R/5RVC-W7V/5RVC-W7V_decoy_scores.csv |
5RWL-NTG | data/5R/5RWL-NTG/5RWL-NTG_ligand.pdbqt | data/5R/5RWL-NTG/5RWL-NTG_target.pdbqt | data/5R/5RWL-NTG/5RWL-NTG_decoys.pdbqt | data/5R/5RWL-NTG/5RWL-NTG_decoy_scores.csv |
5RA4-SVG | data/5R/5RA4-SVG/5RA4-SVG_ligand.pdbqt | data/5R/5RA4-SVG/5RA4-SVG_target.pdbqt | data/5R/5RA4-SVG/5RA4-SVG_decoys.pdbqt | data/5R/5RA4-SVG/5RA4-SVG_decoy_scores.csv |
5RW4-WLV | data/5R/5RW4-WLV/5RW4-WLV_ligand.pdbqt | data/5R/5RW4-WLV/5RW4-WLV_target.pdbqt | data/5R/5RW4-WLV/5RW4-WLV_decoys.pdbqt | data/5R/5RW4-WLV/5RW4-WLV_decoy_scores.csv |
5RZV-WJD | data/5R/5RZV-WJD/5RZV-WJD_ligand.pdbqt | data/5R/5RZV-WJD/5RZV-WJD_target.pdbqt | data/5R/5RZV-WJD/5RZV-WJD_decoys.pdbqt | data/5R/5RZV-WJD/5RZV-WJD_decoy_scores.csv |
5RH5-UHV | data/5R/5RH5-UHV/5RH5-UHV_ligand.pdbqt | data/5R/5RH5-UHV/5RH5-UHV_target.pdbqt | data/5R/5RH5-UHV/5RH5-UHV_decoys.pdbqt | data/5R/5RH5-UHV/5RH5-UHV_decoy_scores.csv |
5R4V-JMM | data/5R/5R4V-JMM/5R4V-JMM_ligand.pdbqt | data/5R/5R4V-JMM/5R4V-JMM_target.pdbqt | data/5R/5R4V-JMM/5R4V-JMM_decoys.pdbqt | data/5R/5R4V-JMM/5R4V-JMM_decoy_scores.csv |
5RFQ-T7Y | data/5R/5RFQ-T7Y/5RFQ-T7Y_ligand.pdbqt | data/5R/5RFQ-T7Y/5RFQ-T7Y_target.pdbqt | data/5R/5RFQ-T7Y/5RFQ-T7Y_decoys.pdbqt | data/5R/5RFQ-T7Y/5RFQ-T7Y_decoy_scores.csv |
5RAD-AYJ | data/5R/5RAD-AYJ/5RAD-AYJ_ligand.pdbqt | data/5R/5RAD-AYJ/5RAD-AYJ_target.pdbqt | data/5R/5RAD-AYJ/5RAD-AYJ_decoys.pdbqt | data/5R/5RAD-AYJ/5RAD-AYJ_decoy_scores.csv |
5RS7-W4Y | data/5R/5RS7-W4Y/5RS7-W4Y_ligand.pdbqt | data/5R/5RS7-W4Y/5RS7-W4Y_target.pdbqt | data/5R/5RS7-W4Y/5RS7-W4Y_decoys.pdbqt | data/5R/5RS7-W4Y/5RS7-W4Y_decoy_scores.csv |
5RZQ-WJ7 | data/5R/5RZQ-WJ7/5RZQ-WJ7_ligand.pdbqt | data/5R/5RZQ-WJ7/5RZQ-WJ7_target.pdbqt | data/5R/5RZQ-WJ7/5RZQ-WJ7_decoys.pdbqt | data/5R/5RZQ-WJ7/5RZQ-WJ7_decoy_scores.csv |
5RKY-UX1 | data/5R/5RKY-UX1/5RKY-UX1_ligand.pdbqt | data/5R/5RKY-UX1/5RKY-UX1_target.pdbqt | data/5R/5RKY-UX1/5RKY-UX1_decoys.pdbqt | data/5R/5RKY-UX1/5RKY-UX1_decoy_scores.csv |
5R1Y-R9J | data/5R/5R1Y-R9J/5R1Y-R9J_ligand.pdbqt | data/5R/5R1Y-R9J/5R1Y-R9J_target.pdbqt | data/5R/5R1Y-R9J/5R1Y-R9J_decoys.pdbqt | data/5R/5R1Y-R9J/5R1Y-R9J_decoy_scores.csv |
5RGI-U0P | data/5R/5RGI-U0P/5RGI-U0P_ligand.pdbqt | data/5R/5RGI-U0P/5RGI-U0P_target.pdbqt | data/5R/5RGI-U0P/5RGI-U0P_decoys.pdbqt | data/5R/5RGI-U0P/5RGI-U0P_decoy_scores.csv |
5R9T-6T5 | data/5R/5R9T-6T5/5R9T-6T5_ligand.pdbqt | data/5R/5R9T-6T5/5R9T-6T5_target.pdbqt | data/5R/5R9T-6T5/5R9T-6T5_decoys.pdbqt | data/5R/5R9T-6T5/5R9T-6T5_decoy_scores.csv |
5R8F-K3Y | data/5R/5R8F-K3Y/5R8F-K3Y_ligand.pdbqt | data/5R/5R8F-K3Y/5R8F-K3Y_target.pdbqt | data/5R/5R8F-K3Y/5R8F-K3Y_decoys.pdbqt | data/5R/5R8F-K3Y/5R8F-K3Y_decoy_scores.csv |
5RAP-S64 | data/5R/5RAP-S64/5RAP-S64_ligand.pdbqt | data/5R/5RAP-S64/5RAP-S64_target.pdbqt | data/5R/5RAP-S64/5RAP-S64_decoys.pdbqt | data/5R/5RAP-S64/5RAP-S64_decoy_scores.csv |
5RU6-2UP | data/5R/5RU6-2UP/5RU6-2UP_ligand.pdbqt | data/5R/5RU6-2UP/5RU6-2UP_target.pdbqt | data/5R/5RU6-2UP/5RU6-2UP_decoys.pdbqt | data/5R/5RU6-2UP/5RU6-2UP_decoy_scores.csv |
5R9X-NZ4 | data/5R/5R9X-NZ4/5R9X-NZ4_ligand.pdbqt | data/5R/5R9X-NZ4/5R9X-NZ4_target.pdbqt | data/5R/5R9X-NZ4/5R9X-NZ4_decoys.pdbqt | data/5R/5R9X-NZ4/5R9X-NZ4_decoy_scores.csv |
5RTG-3HP | data/5R/5RTG-3HP/5RTG-3HP_ligand.pdbqt | data/5R/5RTG-3HP/5RTG-3HP_target.pdbqt | data/5R/5RTG-3HP/5RTG-3HP_decoys.pdbqt | data/5R/5RTG-3HP/5RTG-3HP_decoy_scores.csv |
5RGN-U1A | data/5R/5RGN-U1A/5RGN-U1A_ligand.pdbqt | data/5R/5RGN-U1A/5RGN-U1A_target.pdbqt | data/5R/5RGN-U1A/5RGN-U1A_decoys.pdbqt | data/5R/5RGN-U1A/5RGN-U1A_decoy_scores.csv |
5RFI-T71 | data/5R/5RFI-T71/5RFI-T71_ligand.pdbqt | data/5R/5RFI-T71/5RFI-T71_target.pdbqt | data/5R/5RFI-T71/5RFI-T71_decoys.pdbqt | data/5R/5RFI-T71/5RFI-T71_decoy_scores.csv |
5R5K-S2J | data/5R/5R5K-S2J/5R5K-S2J_ligand.pdbqt | data/5R/5R5K-S2J/5R5K-S2J_target.pdbqt | data/5R/5R5K-S2J/5R5K-S2J_decoys.pdbqt | data/5R/5R5K-S2J/5R5K-S2J_decoy_scores.csv |
5RZL-S7G | data/5R/5RZL-S7G/5RZL-S7G_ligand.pdbqt | data/5R/5RZL-S7G/5RZL-S7G_target.pdbqt | data/5R/5RZL-S7G/5RZL-S7G_decoys.pdbqt | data/5R/5RZL-S7G/5RZL-S7G_decoy_scores.csv |
5RJT-UUM | data/5R/5RJT-UUM/5RJT-UUM_ligand.pdbqt | data/5R/5RJT-UUM/5RJT-UUM_target.pdbqt | data/5R/5RJT-UUM/5RJT-UUM_decoys.pdbqt | data/5R/5RJT-UUM/5RJT-UUM_decoy_scores.csv |
5RAK-N6Y | data/5R/5RAK-N6Y/5RAK-N6Y_ligand.pdbqt | data/5R/5RAK-N6Y/5RAK-N6Y_target.pdbqt | data/5R/5RAK-N6Y/5RAK-N6Y_decoys.pdbqt | data/5R/5RAK-N6Y/5RAK-N6Y_decoy_scores.csv |
5RY9-WKS | data/5R/5RY9-WKS/5RY9-WKS_ligand.pdbqt | data/5R/5RY9-WKS/5RY9-WKS_target.pdbqt | data/5R/5RY9-WKS/5RY9-WKS_decoys.pdbqt | data/5R/5RY9-WKS/5RY9-WKS_decoy_scores.csv |
5RH8-UHM | data/5R/5RH8-UHM/5RH8-UHM_ligand.pdbqt | data/5R/5RH8-UHM/5RH8-UHM_target.pdbqt | data/5R/5RH8-UHM/5RH8-UHM_decoys.pdbqt | data/5R/5RH8-UHM/5RH8-UHM_decoy_scores.csv |
5REV-T4J | data/5R/5REV-T4J/5REV-T4J_ligand.pdbqt | data/5R/5REV-T4J/5REV-T4J_target.pdbqt | data/5R/5REV-T4J/5REV-T4J_decoys.pdbqt | data/5R/5REV-T4J/5REV-T4J_decoy_scores.csv |
5R98-SQG | data/5R/5R98-SQG/5R98-SQG_ligand.pdbqt | data/5R/5R98-SQG/5R98-SQG_target.pdbqt | data/5R/5R98-SQG/5R98-SQG_decoys.pdbqt | data/5R/5R98-SQG/5R98-SQG_decoy_scores.csv |
5RHJ-T6J | data/5R/5RHJ-T6J/5RHJ-T6J_ligand.pdbqt | data/5R/5RHJ-T6J/5RHJ-T6J_target.pdbqt | data/5R/5RHJ-T6J/5RHJ-T6J_decoys.pdbqt | data/5R/5RHJ-T6J/5RHJ-T6J_decoy_scores.csv |
5R0B-SY7 | data/5R/5R0B-SY7/5R0B-SY7_ligand.pdbqt | data/5R/5R0B-SY7/5R0B-SY7_target.pdbqt | data/5R/5R0B-SY7/5R0B-SY7_decoys.pdbqt | data/5R/5R0B-SY7/5R0B-SY7_decoy_scores.csv |
5RT0-4BL | data/5R/5RT0-4BL/5RT0-4BL_ligand.pdbqt | data/5R/5RT0-4BL/5RT0-4BL_target.pdbqt | data/5R/5RT0-4BL/5RT0-4BL_decoys.pdbqt | data/5R/5RT0-4BL/5RT0-4BL_decoy_scores.csv |
5RH1-UGV | data/5R/5RH1-UGV/5RH1-UGV_ligand.pdbqt | data/5R/5RH1-UGV/5RH1-UGV_target.pdbqt | data/5R/5RH1-UGV/5RH1-UGV_decoys.pdbqt | data/5R/5RH1-UGV/5RH1-UGV_decoy_scores.csv |
5RFR-T81 | data/5R/5RFR-T81/5RFR-T81_ligand.pdbqt | data/5R/5RFR-T81/5RFR-T81_target.pdbqt | data/5R/5RFR-T81/5RFR-T81_decoys.pdbqt | data/5R/5RFR-T81/5RFR-T81_decoy_scores.csv |
5RJV-UVD | data/5R/5RJV-UVD/5RJV-UVD_ligand.pdbqt | data/5R/5RJV-UVD/5RJV-UVD_target.pdbqt | data/5R/5RJV-UVD/5RJV-UVD_decoys.pdbqt | data/5R/5RJV-UVD/5RJV-UVD_decoy_scores.csv |
5RAB-S4Y | data/5R/5RAB-S4Y/5RAB-S4Y_ligand.pdbqt | data/5R/5RAB-S4Y/5RAB-S4Y_target.pdbqt | data/5R/5RAB-S4Y/5RAB-S4Y_decoys.pdbqt | data/5R/5RAB-S4Y/5RAB-S4Y_decoy_scores.csv |
5RH7-UJ1 | data/5R/5RH7-UJ1/5RH7-UJ1_ligand.pdbqt | data/5R/5RH7-UJ1/5RH7-UJ1_target.pdbqt | data/5R/5RH7-UJ1/5RH7-UJ1_decoys.pdbqt | data/5R/5RH7-UJ1/5RH7-UJ1_decoy_scores.csv |
5RYQ-NVD | data/5R/5RYQ-NVD/5RYQ-NVD_ligand.pdbqt | data/5R/5RYQ-NVD/5RYQ-NVD_target.pdbqt | data/5R/5RYQ-NVD/5RYQ-NVD_decoys.pdbqt | data/5R/5RYQ-NVD/5RYQ-NVD_decoy_scores.csv |
5R8U-SLS | data/5R/5R8U-SLS/5R8U-SLS_ligand.pdbqt | data/5R/5R8U-SLS/5R8U-SLS_target.pdbqt | data/5R/5R8U-SLS/5R8U-SLS_decoys.pdbqt | data/5R/5R8U-SLS/5R8U-SLS_decoy_scores.csv |
5RME-RYM | data/5R/5RME-RYM/5RME-RYM_ligand.pdbqt | data/5R/5RME-RYM/5RME-RYM_target.pdbqt | data/5R/5RME-RYM/5RME-RYM_decoys.pdbqt | data/5R/5RME-RYM/5RME-RYM_decoy_scores.csv |
5RK6-O1M | data/5R/5RK6-O1M/5RK6-O1M_ligand.pdbqt | data/5R/5RK6-O1M/5RK6-O1M_target.pdbqt | data/5R/5RK6-O1M/5RK6-O1M_decoys.pdbqt | data/5R/5RK6-O1M/5RK6-O1M_decoy_scores.csv |
5R5E-GV1 | data/5R/5R5E-GV1/5R5E-GV1_ligand.pdbqt | data/5R/5R5E-GV1/5R5E-GV1_target.pdbqt | data/5R/5R5E-GV1/5R5E-GV1_decoys.pdbqt | data/5R/5R5E-GV1/5R5E-GV1_decoy_scores.csv |
5R8I-A7N | data/5R/5R8I-A7N/5R8I-A7N_ligand.pdbqt | data/5R/5R8I-A7N/5R8I-A7N_target.pdbqt | data/5R/5R8I-A7N/5R8I-A7N_decoys.pdbqt | data/5R/5R8I-A7N/5R8I-A7N_decoy_scores.csv |
5RJZ-K0J | data/5R/5RJZ-K0J/5RJZ-K0J_ligand.pdbqt | data/5R/5RJZ-K0J/5RJZ-K0J_target.pdbqt | data/5R/5RJZ-K0J/5RJZ-K0J_decoys.pdbqt | data/5R/5RJZ-K0J/5RJZ-K0J_decoy_scores.csv |
5RV0-W6V | data/5R/5RV0-W6V/5RV0-W6V_ligand.pdbqt | data/5R/5RV0-W6V/5RV0-W6V_target.pdbqt | data/5R/5RV0-W6V/5RV0-W6V_decoys.pdbqt | data/5R/5RV0-W6V/5RV0-W6V_decoy_scores.csv |
5RL5-VEY | data/5R/5RL5-VEY/5RL5-VEY_ligand.pdbqt | data/5R/5RL5-VEY/5RL5-VEY_target.pdbqt | data/5R/5RL5-VEY/5RL5-VEY_decoys.pdbqt | data/5R/5RL5-VEY/5RL5-VEY_decoy_scores.csv |
5RWX-K0V | data/5R/5RWX-K0V/5RWX-K0V_ligand.pdbqt | data/5R/5RWX-K0V/5RWX-K0V_target.pdbqt | data/5R/5RWX-K0V/5RWX-K0V_decoys.pdbqt | data/5R/5RWX-K0V/5RWX-K0V_decoy_scores.csv |
5RED-JJG | data/5R/5RED-JJG/5RED-JJG_ligand.pdbqt | data/5R/5RED-JJG/5RED-JJG_target.pdbqt | data/5R/5RED-JJG/5RED-JJG_decoys.pdbqt | data/5R/5RED-JJG/5RED-JJG_decoy_scores.csv |
5RL9-UR7 | data/5R/5RL9-UR7/5RL9-UR7_ligand.pdbqt | data/5R/5RL9-UR7/5RL9-UR7_target.pdbqt | data/5R/5RL9-UR7/5RL9-UR7_decoys.pdbqt | data/5R/5RL9-UR7/5RL9-UR7_decoy_scores.csv |
5RWD-NUJ | data/5R/5RWD-NUJ/5RWD-NUJ_ligand.pdbqt | data/5R/5RWD-NUJ/5RWD-NUJ_target.pdbqt | data/5R/5RWD-NUJ/5RWD-NUJ_decoys.pdbqt | data/5R/5RWD-NUJ/5RWD-NUJ_decoy_scores.csv |
5R4Z-GWA | data/5R/5R4Z-GWA/5R4Z-GWA_ligand.pdbqt | data/5R/5R4Z-GWA/5R4Z-GWA_target.pdbqt | data/5R/5R4Z-GWA/5R4Z-GWA_decoys.pdbqt | data/5R/5R4Z-GWA/5R4Z-GWA_decoy_scores.csv |
5R5V-AXS | data/5R/5R5V-AXS/5R5V-AXS_ligand.pdbqt | data/5R/5R5V-AXS/5R5V-AXS_target.pdbqt | data/5R/5R5V-AXS/5R5V-AXS_decoys.pdbqt | data/5R/5R5V-AXS/5R5V-AXS_decoy_scores.csv |
5RU0-2CL | data/5R/5RU0-2CL/5RU0-2CL_ligand.pdbqt | data/5R/5RU0-2CL/5RU0-2CL_target.pdbqt | data/5R/5RU0-2CL/5RU0-2CL_decoys.pdbqt | data/5R/5RU0-2CL/5RU0-2CL_decoy_scores.csv |
5R8Z-SN4 | data/5R/5R8Z-SN4/5R8Z-SN4_ligand.pdbqt | data/5R/5R8Z-SN4/5R8Z-SN4_target.pdbqt | data/5R/5R8Z-SN4/5R8Z-SN4_decoys.pdbqt | data/5R/5R8Z-SN4/5R8Z-SN4_decoy_scores.csv |
5RTC-EVE | data/5R/5RTC-EVE/5RTC-EVE_ligand.pdbqt | data/5R/5RTC-EVE/5RTC-EVE_target.pdbqt | data/5R/5RTC-EVE/5RTC-EVE_decoys.pdbqt | data/5R/5RTC-EVE/5RTC-EVE_decoy_scores.csv |
5RHI-K2M | data/5R/5RHI-K2M/5RHI-K2M_ligand.pdbqt | data/5R/5RHI-K2M/5RHI-K2M_target.pdbqt | data/5R/5RHI-K2M/5RHI-K2M_decoys.pdbqt | data/5R/5RHI-K2M/5RHI-K2M_decoy_scores.csv |
5RHF-UPJ | data/5R/5RHF-UPJ/5RHF-UPJ_ligand.pdbqt | data/5R/5RHF-UPJ/5RHF-UPJ_target.pdbqt | data/5R/5RHF-UPJ/5RHF-UPJ_decoys.pdbqt | data/5R/5RHF-UPJ/5RHF-UPJ_decoy_scores.csv |
5RSK-W57 | data/5R/5RSK-W57/5RSK-W57_ligand.pdbqt | data/5R/5RSK-W57/5RSK-W57_target.pdbqt | data/5R/5RSK-W57/5RSK-W57_decoys.pdbqt | data/5R/5RSK-W57/5RSK-W57_decoy_scores.csv |
5RSW-6FZ | data/5R/5RSW-6FZ/5RSW-6FZ_ligand.pdbqt | data/5R/5RSW-6FZ/5RSW-6FZ_target.pdbqt | data/5R/5RSW-6FZ/5RSW-6FZ_decoys.pdbqt | data/5R/5RSW-6FZ/5RSW-6FZ_decoy_scores.csv |
5REK-T1Y | data/5R/5REK-T1Y/5REK-T1Y_ligand.pdbqt | data/5R/5REK-T1Y/5REK-T1Y_target.pdbqt | data/5R/5REK-T1Y/5REK-T1Y_decoys.pdbqt | data/5R/5REK-T1Y/5REK-T1Y_decoy_scores.csv |
5RX9-WLJ | data/5R/5RX9-WLJ/5RX9-WLJ_ligand.pdbqt | data/5R/5RX9-WLJ/5RX9-WLJ_target.pdbqt | data/5R/5RX9-WLJ/5RX9-WLJ_decoys.pdbqt | data/5R/5RX9-WLJ/5RX9-WLJ_decoy_scores.csv |
5R9A-SQM | data/5R/5R9A-SQM/5R9A-SQM_ligand.pdbqt | data/5R/5R9A-SQM/5R9A-SQM_target.pdbqt | data/5R/5R9A-SQM/5R9A-SQM_decoys.pdbqt | data/5R/5R9A-SQM/5R9A-SQM_decoy_scores.csv |
5RWY-RWV | data/5R/5RWY-RWV/5RWY-RWV_ligand.pdbqt | data/5R/5RWY-RWV/5RWY-RWV_target.pdbqt | data/5R/5RWY-RWV/5RWY-RWV_decoys.pdbqt | data/5R/5RWY-RWV/5RWY-RWV_decoy_scores.csv |
5RMG-MUK | data/5R/5RMG-MUK/5RMG-MUK_ligand.pdbqt | data/5R/5RMG-MUK/5RMG-MUK_target.pdbqt | data/5R/5RMG-MUK/5RMG-MUK_decoys.pdbqt | data/5R/5RMG-MUK/5RMG-MUK_decoy_scores.csv |
5RKI-K2M | data/5R/5RKI-K2M/5RKI-K2M_ligand.pdbqt | data/5R/5RKI-K2M/5RKI-K2M_target.pdbqt | data/5R/5RKI-K2M/5RKI-K2M_decoys.pdbqt | data/5R/5RKI-K2M/5RKI-K2M_decoy_scores.csv |
5RKW-UX7 | data/5R/5RKW-UX7/5RKW-UX7_ligand.pdbqt | data/5R/5RKW-UX7/5RKW-UX7_target.pdbqt | data/5R/5RKW-UX7/5RKW-UX7_decoys.pdbqt | data/5R/5RKW-UX7/5RKW-UX7_decoy_scores.csv |
5RTH-3BZ | data/5R/5RTH-3BZ/5RTH-3BZ_ligand.pdbqt | data/5R/5RTH-3BZ/5RTH-3BZ_target.pdbqt | data/5R/5RTH-3BZ/5RTH-3BZ_decoys.pdbqt | data/5R/5RTH-3BZ/5RTH-3BZ_decoy_scores.csv |
5RSO-TYZ | data/5R/5RSO-TYZ/5RSO-TYZ_ligand.pdbqt | data/5R/5RSO-TYZ/5RSO-TYZ_target.pdbqt | data/5R/5RSO-TYZ/5RSO-TYZ_decoys.pdbqt | data/5R/5RSO-TYZ/5RSO-TYZ_decoy_scores.csv |
5RY8-BTB | data/5R/5RY8-BTB/5RY8-BTB_ligand.pdbqt | data/5R/5RY8-BTB/5RY8-BTB_target.pdbqt | data/5R/5RY8-BTB/5RY8-BTB_decoys.pdbqt | data/5R/5RY8-BTB/5RY8-BTB_decoy_scores.csv |
5RB4-A6Z | data/5R/5RB4-A6Z/5RB4-A6Z_ligand.pdbqt | data/5R/5RB4-A6Z/5RB4-A6Z_target.pdbqt | data/5R/5RB4-A6Z/5RB4-A6Z_decoys.pdbqt | data/5R/5RB4-A6Z/5RB4-A6Z_decoy_scores.csv |
5RYM-HGE | data/5R/5RYM-HGE/5RYM-HGE_ligand.pdbqt | data/5R/5RYM-HGE/5RYM-HGE_target.pdbqt | data/5R/5RYM-HGE/5RYM-HGE_decoys.pdbqt | data/5R/5RYM-HGE/5RYM-HGE_decoy_scores.csv |
5RJP-UUS | data/5R/5RJP-UUS/5RJP-UUS_ligand.pdbqt | data/5R/5RJP-UUS/5RJP-UUS_target.pdbqt | data/5R/5RJP-UUS/5RJP-UUS_decoys.pdbqt | data/5R/5RJP-UUS/5RJP-UUS_decoy_scores.csv |
5RZA-WHM | data/5R/5RZA-WHM/5RZA-WHM_ligand.pdbqt | data/5R/5RZA-WHM/5RZA-WHM_target.pdbqt | data/5R/5RZA-WHM/5RZA-WHM_decoys.pdbqt | data/5R/5RZA-WHM/5RZA-WHM_decoy_scores.csv |
5RLJ-VW4 | data/5R/5RLJ-VW4/5RLJ-VW4_ligand.pdbqt | data/5R/5RLJ-VW4/5RLJ-VW4_target.pdbqt | data/5R/5RLJ-VW4/5RLJ-VW4_decoys.pdbqt | data/5R/5RLJ-VW4/5RLJ-VW4_decoy_scores.csv |
5RX5-WNM | data/5R/5RX5-WNM/5RX5-WNM_ligand.pdbqt | data/5R/5RX5-WNM/5RX5-WNM_target.pdbqt | data/5R/5RX5-WNM/5RX5-WNM_decoys.pdbqt | data/5R/5RX5-WNM/5RX5-WNM_decoy_scores.csv |
5RW3-WLY | data/5R/5RW3-WLY/5RW3-WLY_ligand.pdbqt | data/5R/5RW3-WLY/5RW3-WLY_target.pdbqt | data/5R/5RW3-WLY/5RW3-WLY_decoys.pdbqt | data/5R/5RW3-WLY/5RW3-WLY_decoy_scores.csv |
5RKP-UWS | data/5R/5RKP-UWS/5RKP-UWS_ligand.pdbqt | data/5R/5RKP-UWS/5RKP-UWS_target.pdbqt | data/5R/5RKP-UWS/5RKP-UWS_decoys.pdbqt | data/5R/5RKP-UWS/5RKP-UWS_decoy_scores.csv |
5RMM-VXG | data/5R/5RMM-VXG/5RMM-VXG_ligand.pdbqt | data/5R/5RMM-VXG/5RMM-VXG_target.pdbqt | data/5R/5RMM-VXG/5RMM-VXG_decoys.pdbqt | data/5R/5RMM-VXG/5RMM-VXG_decoy_scores.csv |
5RFZ-T8V | data/5R/5RFZ-T8V/5RFZ-T8V_ligand.pdbqt | data/5R/5RFZ-T8V/5RFZ-T8V_target.pdbqt | data/5R/5RFZ-T8V/5RFZ-T8V_decoys.pdbqt | data/5R/5RFZ-T8V/5RFZ-T8V_decoy_scores.csv |
5RF6-NTG | data/5R/5RF6-NTG/5RF6-NTG_ligand.pdbqt | data/5R/5RF6-NTG/5RF6-NTG_target.pdbqt | data/5R/5RF6-NTG/5RF6-NTG_decoys.pdbqt | data/5R/5RF6-NTG/5RF6-NTG_decoy_scores.csv |
5RGO-U1G | data/5R/5RGO-U1G/5RGO-U1G_ligand.pdbqt | data/5R/5RGO-U1G/5RGO-U1G_target.pdbqt | data/5R/5RGO-U1G/5RGO-U1G_decoys.pdbqt | data/5R/5RGO-U1G/5RGO-U1G_decoy_scores.csv |
5R9Y-SU7 | data/5R/5R9Y-SU7/5R9Y-SU7_ligand.pdbqt | data/5R/5R9Y-SU7/5R9Y-SU7_target.pdbqt | data/5R/5R9Y-SU7/5R9Y-SU7_decoys.pdbqt | data/5R/5R9Y-SU7/5R9Y-SU7_decoy_scores.csv |
5RUD-2D0 | data/5R/5RUD-2D0/5RUD-2D0_ligand.pdbqt | data/5R/5RUD-2D0/5RUD-2D0_target.pdbqt | data/5R/5RUD-2D0/5RUD-2D0_decoys.pdbqt | data/5R/5RUD-2D0/5RUD-2D0_decoy_scores.csv |
5RYE-T0J | data/5R/5RYE-T0J/5RYE-T0J_ligand.pdbqt | data/5R/5RYE-T0J/5RYE-T0J_target.pdbqt | data/5R/5RYE-T0J/5RYE-T0J_decoys.pdbqt | data/5R/5RYE-T0J/5RYE-T0J_decoy_scores.csv |
5RT1-3A9 | data/5R/5RT1-3A9/5RT1-3A9_ligand.pdbqt | data/5R/5RT1-3A9/5RT1-3A9_target.pdbqt | data/5R/5RT1-3A9/5RT1-3A9_decoys.pdbqt | data/5R/5RT1-3A9/5RT1-3A9_decoy_scores.csv |
5RXJ-WK4 | data/5R/5RXJ-WK4/5RXJ-WK4_ligand.pdbqt | data/5R/5RXJ-WK4/5RXJ-WK4_target.pdbqt | data/5R/5RXJ-WK4/5RXJ-WK4_decoys.pdbqt | data/5R/5RXJ-WK4/5RXJ-WK4_decoy_scores.csv |
5RZI-WHS | data/5R/5RZI-WHS/5RZI-WHS_ligand.pdbqt | data/5R/5RZI-WHS/5RZI-WHS_target.pdbqt | data/5R/5RZI-WHS/5RZI-WHS_decoys.pdbqt | data/5R/5RZI-WHS/5RZI-WHS_decoy_scores.csv |
5R28-RDJ | data/5R/5R28-RDJ/5R28-RDJ_ligand.pdbqt | data/5R/5R28-RDJ/5R28-RDJ_target.pdbqt | data/5R/5R28-RDJ/5R28-RDJ_decoys.pdbqt | data/5R/5R28-RDJ/5R28-RDJ_decoy_scores.csv |
5RWM-NU4 | data/5R/5RWM-NU4/5RWM-NU4_ligand.pdbqt | data/5R/5RWM-NU4/5RWM-NU4_target.pdbqt | data/5R/5RWM-NU4/5RWM-NU4_decoys.pdbqt | data/5R/5RWM-NU4/5RWM-NU4_decoy_scores.csv |
5RLN-NZG | data/5R/5RLN-NZG/5RLN-NZG_ligand.pdbqt | data/5R/5RLN-NZG/5RLN-NZG_target.pdbqt | data/5R/5RLN-NZG/5RLN-NZG_decoys.pdbqt | data/5R/5RLN-NZG/5RLN-NZG_decoy_scores.csv |
5RA2-SV4 | data/5R/5RA2-SV4/5RA2-SV4_ligand.pdbqt | data/5R/5RA2-SV4/5RA2-SV4_target.pdbqt | data/5R/5RA2-SV4/5RA2-SV4_decoys.pdbqt | data/5R/5RA2-SV4/5RA2-SV4_decoy_scores.csv |
5RTP-AOT | data/5R/5RTP-AOT/5RTP-AOT_ligand.pdbqt | data/5R/5RTP-AOT/5RTP-AOT_target.pdbqt | data/5R/5RTP-AOT/5RTP-AOT_decoys.pdbqt | data/5R/5RTP-AOT/5RTP-AOT_decoy_scores.csv |
5RJO-1P8 | data/5R/5RJO-1P8/5RJO-1P8_ligand.pdbqt | data/5R/5RJO-1P8/5RJO-1P8_target.pdbqt | data/5R/5RJO-1P8/5RJO-1P8_decoys.pdbqt | data/5R/5RJO-1P8/5RJO-1P8_decoy_scores.csv |
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