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 ⌀ |
|---|---|---|---|---|
5RVS-0LO | data/5R/5RVS-0LO/5RVS-0LO_ligand.pdbqt | data/5R/5RVS-0LO/5RVS-0LO_target.pdbqt | data/5R/5RVS-0LO/5RVS-0LO_decoys.pdbqt | data/5R/5RVS-0LO/5RVS-0LO_decoy_scores.csv |
5R5F-N08 | data/5R/5R5F-N08/5R5F-N08_ligand.pdbqt | data/5R/5R5F-N08/5R5F-N08_target.pdbqt | data/5R/5R5F-N08/5R5F-N08_decoys.pdbqt | data/5R/5R5F-N08/5R5F-N08_decoy_scores.csv |
5RL3-VEP | data/5R/5RL3-VEP/5RL3-VEP_ligand.pdbqt | data/5R/5RL3-VEP/5RL3-VEP_target.pdbqt | data/5R/5RL3-VEP/5RL3-VEP_decoys.pdbqt | data/5R/5RL3-VEP/5RL3-VEP_decoy_scores.csv |
5RLE-VVP | data/5R/5RLE-VVP/5RLE-VVP_ligand.pdbqt | data/5R/5RLE-VVP/5RLE-VVP_target.pdbqt | data/5R/5RLE-VVP/5RLE-VVP_decoys.pdbqt | data/5R/5RLE-VVP/5RLE-VVP_decoy_scores.csv |
5RWT-JMM | data/5R/5RWT-JMM/5RWT-JMM_ligand.pdbqt | data/5R/5RWT-JMM/5RWT-JMM_target.pdbqt | data/5R/5RWT-JMM/5RWT-JMM_decoys.pdbqt | data/5R/5RWT-JMM/5RWT-JMM_decoy_scores.csv |
5R8A-S7G | data/5R/5R8A-S7G/5R8A-S7G_ligand.pdbqt | data/5R/5R8A-S7G/5R8A-S7G_target.pdbqt | data/5R/5R8A-S7G/5R8A-S7G_decoys.pdbqt | data/5R/5R8A-S7G/5R8A-S7G_decoy_scores.csv |
5RLD-VVY | data/5R/5RLD-VVY/5RLD-VVY_ligand.pdbqt | data/5R/5RLD-VVY/5RLD-VVY_target.pdbqt | data/5R/5RLD-VVY/5RLD-VVY_decoys.pdbqt | data/5R/5RLD-VVY/5RLD-VVY_decoy_scores.csv |
5R8K-S8D | data/5R/5R8K-S8D/5R8K-S8D_ligand.pdbqt | data/5R/5R8K-S8D/5R8K-S8D_target.pdbqt | data/5R/5R8K-S8D/5R8K-S8D_decoys.pdbqt | data/5R/5R8K-S8D/5R8K-S8D_decoy_scores.csv |
5RT2-5OF | data/5R/5RT2-5OF/5RT2-5OF_ligand.pdbqt | data/5R/5RT2-5OF/5RT2-5OF_target.pdbqt | data/5R/5RT2-5OF/5RT2-5OF_decoys.pdbqt | data/5R/5RT2-5OF/5RT2-5OF_decoy_scores.csv |
5R0E-SY4 | data/5R/5R0E-SY4/5R0E-SY4_ligand.pdbqt | data/5R/5R0E-SY4/5R0E-SY4_target.pdbqt | data/5R/5R0E-SY4/5R0E-SY4_decoys.pdbqt | data/5R/5R0E-SY4/5R0E-SY4_decoy_scores.csv |
5RT5-07L | data/5R/5RT5-07L/5RT5-07L_ligand.pdbqt | data/5R/5RT5-07L/5RT5-07L_target.pdbqt | data/5R/5RT5-07L/5RT5-07L_decoys.pdbqt | data/5R/5RT5-07L/5RT5-07L_decoy_scores.csv |
5RYF-WHV | data/5R/5RYF-WHV/5RYF-WHV_ligand.pdbqt | data/5R/5RYF-WHV/5RYF-WHV_target.pdbqt | data/5R/5RYF-WHV/5RYF-WHV_decoys.pdbqt | data/5R/5RYF-WHV/5RYF-WHV_decoy_scores.csv |
5R8J-S8D | data/5R/5R8J-S8D/5R8J-S8D_ligand.pdbqt | data/5R/5R8J-S8D/5R8J-S8D_target.pdbqt | data/5R/5R8J-S8D/5R8J-S8D_decoys.pdbqt | data/5R/5R8J-S8D/5R8J-S8D_decoy_scores.csv |
5R61-K1P | data/5R/5R61-K1P/5R61-K1P_ligand.pdbqt | data/5R/5R61-K1P/5R61-K1P_target.pdbqt | data/5R/5R61-K1P/5R61-K1P_decoys.pdbqt | data/5R/5R61-K1P/5R61-K1P_decoy_scores.csv |
5RT4-4BX | data/5R/5RT4-4BX/5RT4-4BX_ligand.pdbqt | data/5R/5RT4-4BX/5RT4-4BX_target.pdbqt | data/5R/5RT4-4BX/5RT4-4BX_decoys.pdbqt | data/5R/5RT4-4BX/5RT4-4BX_decoy_scores.csv |
5RXB-RX7 | data/5R/5RXB-RX7/5RXB-RX7_ligand.pdbqt | data/5R/5RXB-RX7/5RXB-RX7_target.pdbqt | data/5R/5RXB-RX7/5RXB-RX7_decoys.pdbqt | data/5R/5RXB-RX7/5RXB-RX7_decoy_scores.csv |
5R4W-RWP | data/5R/5R4W-RWP/5R4W-RWP_ligand.pdbqt | data/5R/5R4W-RWP/5R4W-RWP_target.pdbqt | data/5R/5R4W-RWP/5R4W-RWP_decoys.pdbqt | data/5R/5R4W-RWP/5R4W-RWP_decoy_scores.csv |
5RZC-O0P | data/5R/5RZC-O0P/5RZC-O0P_ligand.pdbqt | data/5R/5RZC-O0P/5RZC-O0P_target.pdbqt | data/5R/5RZC-O0P/5RZC-O0P_decoys.pdbqt | data/5R/5RZC-O0P/5RZC-O0P_decoy_scores.csv |
5R60-RXG | data/5R/5R60-RXG/5R60-RXG_ligand.pdbqt | data/5R/5R60-RXG/5R60-RXG_target.pdbqt | data/5R/5R60-RXG/5R60-RXG_decoys.pdbqt | data/5R/5R60-RXG/5R60-RXG_decoy_scores.csv |
5RKQ-UXJ | data/5R/5RKQ-UXJ/5RKQ-UXJ_ligand.pdbqt | data/5R/5RKQ-UXJ/5RKQ-UXJ_target.pdbqt | data/5R/5RKQ-UXJ/5RKQ-UXJ_decoys.pdbqt | data/5R/5RKQ-UXJ/5RKQ-UXJ_decoy_scores.csv |
5RFP-T7V | data/5R/5RFP-T7V/5RFP-T7V_ligand.pdbqt | data/5R/5RFP-T7V/5RFP-T7V_target.pdbqt | data/5R/5RFP-T7V/5RFP-T7V_decoys.pdbqt | data/5R/5RFP-T7V/5RFP-T7V_decoy_scores.csv |
5R4G-RU4 | data/5R/5R4G-RU4/5R4G-RU4_ligand.pdbqt | data/5R/5R4G-RU4/5R4G-RU4_target.pdbqt | data/5R/5R4G-RU4/5R4G-RU4_decoys.pdbqt | data/5R/5R4G-RU4/5R4G-RU4_decoy_scores.csv |
5R4T-RWG | data/5R/5R4T-RWG/5R4T-RWG_ligand.pdbqt | data/5R/5R4T-RWG/5R4T-RWG_target.pdbqt | data/5R/5R4T-RWG/5R4T-RWG_decoys.pdbqt | data/5R/5R4T-RWG/5R4T-RWG_decoy_scores.csv |
5R80-RZG | data/5R/5R80-RZG/5R80-RZG_ligand.pdbqt | data/5R/5R80-RZG/5R80-RZG_target.pdbqt | data/5R/5R80-RZG/5R80-RZG_decoys.pdbqt | data/5R/5R80-RZG/5R80-RZG_decoy_scores.csv |
5R5N-JHP | data/5R/5R5N-JHP/5R5N-JHP_ligand.pdbqt | data/5R/5R5N-JHP/5R5N-JHP_target.pdbqt | data/5R/5R5N-JHP/5R5N-JHP_decoys.pdbqt | data/5R/5R5N-JHP/5R5N-JHP_decoy_scores.csv |
5RGW-UGM | data/5R/5RGW-UGM/5RGW-UGM_ligand.pdbqt | data/5R/5RGW-UGM/5RGW-UGM_target.pdbqt | data/5R/5RGW-UGM/5RGW-UGM_decoys.pdbqt | data/5R/5RGW-UGM/5RGW-UGM_decoy_scores.csv |
5RXR-WKY | data/5R/5RXR-WKY/5RXR-WKY_ligand.pdbqt | data/5R/5RXR-WKY/5RXR-WKY_target.pdbqt | data/5R/5RXR-WKY/5RXR-WKY_decoys.pdbqt | data/5R/5RXR-WKY/5RXR-WKY_decoy_scores.csv |
5RML-VXD | data/5R/5RML-VXD/5RML-VXD_ligand.pdbqt | data/5R/5RML-VXD/5RML-VXD_target.pdbqt | data/5R/5RML-VXD/5RML-VXD_decoys.pdbqt | data/5R/5RML-VXD/5RML-VXD_decoy_scores.csv |
5RHQ-JFS | data/5R/5RHQ-JFS/5RHQ-JFS_ligand.pdbqt | data/5R/5RHQ-JFS/5RHQ-JFS_target.pdbqt | data/5R/5RHQ-JFS/5RHQ-JFS_decoys.pdbqt | data/5R/5RHQ-JFS/5RHQ-JFS_decoy_scores.csv |
5R9K-SR4 | data/5R/5R9K-SR4/5R9K-SR4_ligand.pdbqt | data/5R/5R9K-SR4/5R9K-SR4_target.pdbqt | data/5R/5R9K-SR4/5R9K-SR4_decoys.pdbqt | data/5R/5R9K-SR4/5R9K-SR4_decoy_scores.csv |
5REW-T4M | data/5R/5REW-T4M/5REW-T4M_ligand.pdbqt | data/5R/5REW-T4M/5REW-T4M_target.pdbqt | data/5R/5REW-T4M/5REW-T4M_decoys.pdbqt | data/5R/5REW-T4M/5REW-T4M_decoy_scores.csv |
5RTW-OHP | data/5R/5RTW-OHP/5RTW-OHP_ligand.pdbqt | data/5R/5RTW-OHP/5RTW-OHP_target.pdbqt | data/5R/5RTW-OHP/5RTW-OHP_decoys.pdbqt | data/5R/5RTW-OHP/5RTW-OHP_decoy_scores.csv |
5RWH-VZM | data/5R/5RWH-VZM/5RWH-VZM_ligand.pdbqt | data/5R/5RWH-VZM/5RWH-VZM_target.pdbqt | data/5R/5RWH-VZM/5RWH-VZM_decoys.pdbqt | data/5R/5RWH-VZM/5RWH-VZM_decoy_scores.csv |
5RGJ-U0S | data/5R/5RGJ-U0S/5RGJ-U0S_ligand.pdbqt | data/5R/5RGJ-U0S/5RGJ-U0S_target.pdbqt | data/5R/5RGJ-U0S/5RGJ-U0S_decoys.pdbqt | data/5R/5RGJ-U0S/5RGJ-U0S_decoy_scores.csv |
5R1Z-R9M | data/5R/5R1Z-R9M/5R1Z-R9M_ligand.pdbqt | data/5R/5R1Z-R9M/5R1Z-R9M_target.pdbqt | data/5R/5R1Z-R9M/5R1Z-R9M_decoys.pdbqt | data/5R/5R1Z-R9M/5R1Z-R9M_decoy_scores.csv |
5R8M-S8G | data/5R/5R8M-S8G/5R8M-S8G_ligand.pdbqt | data/5R/5R8M-S8G/5R8M-S8G_target.pdbqt | data/5R/5R8M-S8G/5R8M-S8G_decoys.pdbqt | data/5R/5R8M-S8G/5R8M-S8G_decoy_scores.csv |
5RJU-O2D | data/5R/5RJU-O2D/5RJU-O2D_ligand.pdbqt | data/5R/5RJU-O2D/5RJU-O2D_target.pdbqt | data/5R/5RJU-O2D/5RJU-O2D_decoys.pdbqt | data/5R/5RJU-O2D/5RJU-O2D_decoy_scores.csv |
5R8P-S8V | data/5R/5R8P-S8V/5R8P-S8V_ligand.pdbqt | data/5R/5R8P-S8V/5R8P-S8V_target.pdbqt | data/5R/5R8P-S8V/5R8P-S8V_decoys.pdbqt | data/5R/5R8P-S8V/5R8P-S8V_decoy_scores.csv |
5RX2-WM7 | data/5R/5RX2-WM7/5RX2-WM7_ligand.pdbqt | data/5R/5RX2-WM7/5RX2-WM7_target.pdbqt | data/5R/5RX2-WM7/5RX2-WM7_decoys.pdbqt | data/5R/5RX2-WM7/5RX2-WM7_decoy_scores.csv |
5R89-S7D | data/5R/5R89-S7D/5R89-S7D_ligand.pdbqt | data/5R/5R89-S7D/5R89-S7D_target.pdbqt | data/5R/5R89-S7D/5R89-S7D_decoys.pdbqt | data/5R/5R89-S7D/5R89-S7D_decoy_scores.csv |
5RY2-W0M | data/5R/5RY2-W0M/5RY2-W0M_ligand.pdbqt | data/5R/5RY2-W0M/5RY2-W0M_target.pdbqt | data/5R/5RY2-W0M/5RY2-W0M_decoys.pdbqt | data/5R/5RY2-W0M/5RY2-W0M_decoy_scores.csv |
5RLU-JG4 | data/5R/5RLU-JG4/5RLU-JG4_ligand.pdbqt | data/5R/5RLU-JG4/5RLU-JG4_target.pdbqt | data/5R/5RLU-JG4/5RLU-JG4_decoys.pdbqt | data/5R/5RLU-JG4/5RLU-JG4_decoy_scores.csv |
5RVJ-4JQ | data/5R/5RVJ-4JQ/5RVJ-4JQ_ligand.pdbqt | data/5R/5RVJ-4JQ/5RVJ-4JQ_target.pdbqt | data/5R/5RVJ-4JQ/5RVJ-4JQ_decoys.pdbqt | data/5R/5RVJ-4JQ/5RVJ-4JQ_decoy_scores.csv |
5R8E-S7S | data/5R/5R8E-S7S/5R8E-S7S_ligand.pdbqt | data/5R/5R8E-S7S/5R8E-S7S_target.pdbqt | data/5R/5R8E-S7S/5R8E-S7S_decoys.pdbqt | data/5R/5R8E-S7S/5R8E-S7S_decoy_scores.csv |
5RUI-4YS | data/5R/5RUI-4YS/5RUI-4YS_ligand.pdbqt | data/5R/5RUI-4YS/5RUI-4YS_target.pdbqt | data/5R/5RUI-4YS/5RUI-4YS_decoys.pdbqt | data/5R/5RUI-4YS/5RUI-4YS_decoy_scores.csv |
5RSV-4MB | data/5R/5RSV-4MB/5RSV-4MB_ligand.pdbqt | data/5R/5RSV-4MB/5RSV-4MB_target.pdbqt | data/5R/5RSV-4MB/5RSV-4MB_decoys.pdbqt | data/5R/5RSV-4MB/5RSV-4MB_decoy_scores.csv |
5RZS-UR7 | data/5R/5RZS-UR7/5RZS-UR7_ligand.pdbqt | data/5R/5RZS-UR7/5RZS-UR7_target.pdbqt | data/5R/5RZS-UR7/5RZS-UR7_decoys.pdbqt | data/5R/5RZS-UR7/5RZS-UR7_decoy_scores.csv |
5RE8-T0V | data/5R/5RE8-T0V/5RE8-T0V_ligand.pdbqt | data/5R/5RE8-T0V/5RE8-T0V_target.pdbqt | data/5R/5RE8-T0V/5RE8-T0V_decoys.pdbqt | data/5R/5RE8-T0V/5RE8-T0V_decoy_scores.csv |
5RH9-UJ4 | data/5R/5RH9-UJ4/5RH9-UJ4_ligand.pdbqt | data/5R/5RH9-UJ4/5RH9-UJ4_target.pdbqt | data/5R/5RH9-UJ4/5RH9-UJ4_decoys.pdbqt | data/5R/5RH9-UJ4/5RH9-UJ4_decoy_scores.csv |
5REH-AWP | data/5R/5REH-AWP/5REH-AWP_ligand.pdbqt | data/5R/5REH-AWP/5REH-AWP_target.pdbqt | data/5R/5REH-AWP/5REH-AWP_decoys.pdbqt | data/5R/5REH-AWP/5REH-AWP_decoy_scores.csv |
5RUK-NVU | data/5R/5RUK-NVU/5RUK-NVU_ligand.pdbqt | data/5R/5RUK-NVU/5RUK-NVU_target.pdbqt | data/5R/5RUK-NVU/5RUK-NVU_decoys.pdbqt | data/5R/5RUK-NVU/5RUK-NVU_decoy_scores.csv |
5RFJ-T7A | data/5R/5RFJ-T7A/5RFJ-T7A_ligand.pdbqt | data/5R/5RFJ-T7A/5RFJ-T7A_target.pdbqt | data/5R/5RFJ-T7A/5RFJ-T7A_decoys.pdbqt | data/5R/5RFJ-T7A/5RFJ-T7A_decoy_scores.csv |
5RV8-8EJ | data/5R/5RV8-8EJ/5RV8-8EJ_ligand.pdbqt | data/5R/5RV8-8EJ/5RV8-8EJ_target.pdbqt | data/5R/5RV8-8EJ/5RV8-8EJ_decoys.pdbqt | data/5R/5RV8-8EJ/5RV8-8EJ_decoy_scores.csv |
5R9O-54F | data/5R/5R9O-54F/5R9O-54F_ligand.pdbqt | data/5R/5R9O-54F/5R9O-54F_target.pdbqt | data/5R/5R9O-54F/5R9O-54F_decoys.pdbqt | data/5R/5R9O-54F/5R9O-54F_decoy_scores.csv |
5RY0-WNY | data/5R/5RY0-WNY/5RY0-WNY_ligand.pdbqt | data/5R/5RY0-WNY/5RY0-WNY_target.pdbqt | data/5R/5RY0-WNY/5RY0-WNY_decoys.pdbqt | data/5R/5RY0-WNY/5RY0-WNY_decoy_scores.csv |
5RUH-KNL | data/5R/5RUH-KNL/5RUH-KNL_ligand.pdbqt | data/5R/5RUH-KNL/5RUH-KNL_target.pdbqt | data/5R/5RUH-KNL/5RUH-KNL_decoys.pdbqt | data/5R/5RUH-KNL/5RUH-KNL_decoy_scores.csv |
5R4U-RWM | data/5R/5R4U-RWM/5R4U-RWM_ligand.pdbqt | data/5R/5R4U-RWM/5R4U-RWM_target.pdbqt | data/5R/5R4U-RWM/5R4U-RWM_decoys.pdbqt | data/5R/5R4U-RWM/5R4U-RWM_decoy_scores.csv |
5R5B-S1G | data/5R/5R5B-S1G/5R5B-S1G_ligand.pdbqt | data/5R/5R5B-S1G/5R5B-S1G_target.pdbqt | data/5R/5R5B-S1G/5R5B-S1G_decoys.pdbqt | data/5R/5R5B-S1G/5R5B-S1G_decoy_scores.csv |
5RF8-SFY | data/5R/5RF8-SFY/5RF8-SFY_ligand.pdbqt | data/5R/5RF8-SFY/5RF8-SFY_target.pdbqt | data/5R/5RF8-SFY/5RF8-SFY_decoys.pdbqt | data/5R/5RF8-SFY/5RF8-SFY_decoy_scores.csv |
5R2C-RE4 | data/5R/5R2C-RE4/5R2C-RE4_ligand.pdbqt | data/5R/5R2C-RE4/5R2C-RE4_target.pdbqt | data/5R/5R2C-RE4/5R2C-RE4_decoys.pdbqt | data/5R/5R2C-RE4/5R2C-RE4_decoy_scores.csv |
5RK7-UVM | data/5R/5RK7-UVM/5RK7-UVM_ligand.pdbqt | data/5R/5RK7-UVM/5RK7-UVM_target.pdbqt | data/5R/5RK7-UVM/5RK7-UVM_decoys.pdbqt | data/5R/5RK7-UVM/5RK7-UVM_decoy_scores.csv |
5RWO-AXG | data/5R/5RWO-AXG/5RWO-AXG_ligand.pdbqt | data/5R/5RWO-AXG/5RWO-AXG_target.pdbqt | data/5R/5RWO-AXG/5RWO-AXG_decoys.pdbqt | data/5R/5RWO-AXG/5RWO-AXG_decoy_scores.csv |
5R82-RZS | data/5R/5R82-RZS/5R82-RZS_ligand.pdbqt | data/5R/5R82-RZS/5R82-RZS_target.pdbqt | data/5R/5R82-RZS/5R82-RZS_decoys.pdbqt | data/5R/5R82-RZS/5R82-RZS_decoy_scores.csv |
5RMD-VWY | data/5R/5RMD-VWY/5RMD-VWY_ligand.pdbqt | data/5R/5RMD-VWY/5RMD-VWY_target.pdbqt | data/5R/5RMD-VWY/5RMD-VWY_decoys.pdbqt | data/5R/5RMD-VWY/5RMD-VWY_decoy_scores.csv |
5RWG-S07 | data/5R/5RWG-S07/5RWG-S07_ligand.pdbqt | data/5R/5RWG-S07/5RWG-S07_target.pdbqt | data/5R/5RWG-S07/5RWG-S07_decoys.pdbqt | data/5R/5RWG-S07/5RWG-S07_decoy_scores.csv |
5RTU-1FF | data/5R/5RTU-1FF/5RTU-1FF_ligand.pdbqt | data/5R/5RTU-1FF/5RTU-1FF_target.pdbqt | data/5R/5RTU-1FF/5RTU-1FF_decoys.pdbqt | data/5R/5RTU-1FF/5RTU-1FF_decoy_scores.csv |
5RLS-VWG | data/5R/5RLS-VWG/5RLS-VWG_ligand.pdbqt | data/5R/5RLS-VWG/5RLS-VWG_target.pdbqt | data/5R/5RLS-VWG/5RLS-VWG_decoys.pdbqt | data/5R/5RLS-VWG/5RLS-VWG_decoy_scores.csv |
5RK1-UV1 | data/5R/5RK1-UV1/5RK1-UV1_ligand.pdbqt | data/5R/5RK1-UV1/5RK1-UV1_target.pdbqt | data/5R/5RK1-UV1/5RK1-UV1_decoys.pdbqt | data/5R/5RK1-UV1/5RK1-UV1_decoy_scores.csv |
5R5W-EJQ | data/5R/5R5W-EJQ/5R5W-EJQ_ligand.pdbqt | data/5R/5R5W-EJQ/5R5W-EJQ_target.pdbqt | data/5R/5R5W-EJQ/5R5W-EJQ_decoys.pdbqt | data/5R/5R5W-EJQ/5R5W-EJQ_decoy_scores.csv |
5RLM-VW7 | data/5R/5RLM-VW7/5RLM-VW7_ligand.pdbqt | data/5R/5RLM-VW7/5RLM-VW7_target.pdbqt | data/5R/5RLM-VW7/5RLM-VW7_decoys.pdbqt | data/5R/5RLM-VW7/5RLM-VW7_decoy_scores.csv |
5RFU-T8D | data/5R/5RFU-T8D/5RFU-T8D_ligand.pdbqt | data/5R/5RFU-T8D/5RFU-T8D_target.pdbqt | data/5R/5RFU-T8D/5RFU-T8D_decoys.pdbqt | data/5R/5RFU-T8D/5RFU-T8D_decoy_scores.csv |
5RFS-T84 | data/5R/5RFS-T84/5RFS-T84_ligand.pdbqt | data/5R/5RFS-T84/5RFS-T84_target.pdbqt | data/5R/5RFS-T84/5RFS-T84_decoys.pdbqt | data/5R/5RFS-T84/5RFS-T84_decoy_scores.csv |
5R2A-RDV | data/5R/5R2A-RDV/5R2A-RDV_ligand.pdbqt | data/5R/5R2A-RDV/5R2A-RDV_target.pdbqt | data/5R/5R2A-RDV/5R2A-RDV_decoys.pdbqt | data/5R/5R2A-RDV/5R2A-RDV_decoy_scores.csv |
5RGU-UGD | data/5R/5RGU-UGD/5RGU-UGD_ligand.pdbqt | data/5R/5RGU-UGD/5RGU-UGD_target.pdbqt | data/5R/5RGU-UGD/5RGU-UGD_decoys.pdbqt | data/5R/5RGU-UGD/5RGU-UGD_decoy_scores.csv |
5RZ2-WH1 | data/5R/5RZ2-WH1/5RZ2-WH1_ligand.pdbqt | data/5R/5RZ2-WH1/5RZ2-WH1_target.pdbqt | data/5R/5RZ2-WH1/5RZ2-WH1_decoys.pdbqt | data/5R/5RZ2-WH1/5RZ2-WH1_decoy_scores.csv |
5R0A-SYA | data/5R/5R0A-SYA/5R0A-SYA_ligand.pdbqt | data/5R/5R0A-SYA/5R0A-SYA_target.pdbqt | data/5R/5R0A-SYA/5R0A-SYA_decoys.pdbqt | data/5R/5R0A-SYA/5R0A-SYA_decoy_scores.csv |
5RXT-RXS | data/5R/5RXT-RXS/5RXT-RXS_ligand.pdbqt | data/5R/5RXT-RXS/5RXT-RXS_target.pdbqt | data/5R/5RXT-RXS/5RXT-RXS_decoys.pdbqt | data/5R/5RXT-RXS/5RXT-RXS_decoy_scores.csv |
5RFY-T8S | data/5R/5RFY-T8S/5RFY-T8S_ligand.pdbqt | data/5R/5RFY-T8S/5RFY-T8S_target.pdbqt | data/5R/5RFY-T8S/5RFY-T8S_decoys.pdbqt | data/5R/5RFY-T8S/5RFY-T8S_decoy_scores.csv |
5RB1-S4V | data/5R/5RB1-S4V/5RB1-S4V_ligand.pdbqt | data/5R/5RB1-S4V/5RB1-S4V_target.pdbqt | data/5R/5RB1-S4V/5RB1-S4V_decoys.pdbqt | data/5R/5RB1-S4V/5RB1-S4V_decoy_scores.csv |
5R8W-JND | data/5R/5R8W-JND/5R8W-JND_ligand.pdbqt | data/5R/5R8W-JND/5R8W-JND_target.pdbqt | data/5R/5R8W-JND/5R8W-JND_decoys.pdbqt | data/5R/5R8W-JND/5R8W-JND_decoy_scores.csv |
5RGT-UHS | data/5R/5RGT-UHS/5RGT-UHS_ligand.pdbqt | data/5R/5RGT-UHS/5RGT-UHS_target.pdbqt | data/5R/5RGT-UHS/5RGT-UHS_decoys.pdbqt | data/5R/5RGT-UHS/5RGT-UHS_decoy_scores.csv |
5RZ7-AYV | data/5R/5RZ7-AYV/5RZ7-AYV_ligand.pdbqt | data/5R/5RZ7-AYV/5RZ7-AYV_target.pdbqt | data/5R/5RZ7-AYV/5RZ7-AYV_decoys.pdbqt | data/5R/5RZ7-AYV/5RZ7-AYV_decoy_scores.csv |
5REI-T1S | data/5R/5REI-T1S/5REI-T1S_ligand.pdbqt | data/5R/5REI-T1S/5REI-T1S_target.pdbqt | data/5R/5REI-T1S/5REI-T1S_decoys.pdbqt | data/5R/5REI-T1S/5REI-T1S_decoy_scores.csv |
5RW2-T0V | data/5R/5RW2-T0V/5RW2-T0V_ligand.pdbqt | data/5R/5RW2-T0V/5RW2-T0V_target.pdbqt | data/5R/5RW2-T0V/5RW2-T0V_decoys.pdbqt | data/5R/5RW2-T0V/5RW2-T0V_decoy_scores.csv |
5RGS-S7V | data/5R/5RGS-S7V/5RGS-S7V_ligand.pdbqt | data/5R/5RGS-S7V/5RGS-S7V_target.pdbqt | data/5R/5RGS-S7V/5RGS-S7V_decoys.pdbqt | data/5R/5RGS-S7V/5RGS-S7V_decoy_scores.csv |
5RW7-WMY | data/5R/5RW7-WMY/5RW7-WMY_ligand.pdbqt | data/5R/5RW7-WMY/5RW7-WMY_target.pdbqt | data/5R/5RW7-WMY/5RW7-WMY_decoys.pdbqt | data/5R/5RW7-WMY/5RW7-WMY_decoy_scores.csv |
5R51-RU4 | data/5R/5R51-RU4/5R51-RU4_ligand.pdbqt | data/5R/5R51-RU4/5R51-RU4_target.pdbqt | data/5R/5R51-RU4/5R51-RU4_decoys.pdbqt | data/5R/5R51-RU4/5R51-RU4_decoy_scores.csv |
5RSE-W5P | data/5R/5RSE-W5P/5RSE-W5P_ligand.pdbqt | data/5R/5RSE-W5P/5RSE-W5P_target.pdbqt | data/5R/5RSE-W5P/5RSE-W5P_decoys.pdbqt | data/5R/5RSE-W5P/5RSE-W5P_decoy_scores.csv |
5RHA-T8M | data/5R/5RHA-T8M/5RHA-T8M_ligand.pdbqt | data/5R/5RHA-T8M/5RHA-T8M_target.pdbqt | data/5R/5RHA-T8M/5RHA-T8M_decoys.pdbqt | data/5R/5RHA-T8M/5RHA-T8M_decoy_scores.csv |
5R4S-RWD | data/5R/5R4S-RWD/5R4S-RWD_ligand.pdbqt | data/5R/5R4S-RWD/5R4S-RWD_target.pdbqt | data/5R/5R4S-RWD/5R4S-RWD_decoys.pdbqt | data/5R/5R4S-RWD/5R4S-RWD_decoy_scores.csv |
5R1U-T9G | data/5R/5R1U-T9G/5R1U-T9G_ligand.pdbqt | data/5R/5R1U-T9G/5R1U-T9G_target.pdbqt | data/5R/5R1U-T9G/5R1U-T9G_decoys.pdbqt | data/5R/5R1U-T9G/5R1U-T9G_decoy_scores.csv |
5RZZ-WJJ | data/5R/5RZZ-WJJ/5RZZ-WJJ_ligand.pdbqt | data/5R/5RZZ-WJJ/5RZZ-WJJ_target.pdbqt | data/5R/5RZZ-WJJ/5RZZ-WJJ_decoys.pdbqt | data/5R/5RZZ-WJJ/5RZZ-WJJ_decoy_scores.csv |
5RSJ-W5A | data/5R/5RSJ-W5A/5RSJ-W5A_ligand.pdbqt | data/5R/5RSJ-W5A/5RSJ-W5A_target.pdbqt | data/5R/5RSJ-W5A/5RSJ-W5A_decoys.pdbqt | data/5R/5RSJ-W5A/5RSJ-W5A_decoy_scores.csv |
5RGQ-U1V | data/5R/5RGQ-U1V/5RGQ-U1V_ligand.pdbqt | data/5R/5RGQ-U1V/5RGQ-U1V_target.pdbqt | data/5R/5RGQ-U1V/5RGQ-U1V_decoys.pdbqt | data/5R/5RGQ-U1V/5RGQ-U1V_decoy_scores.csv |
5R87-K0G | data/5R/5R87-K0G/5R87-K0G_ligand.pdbqt | data/5R/5R87-K0G/5R87-K0G_target.pdbqt | data/5R/5R87-K0G/5R87-K0G_decoys.pdbqt | data/5R/5R87-K0G/5R87-K0G_decoy_scores.csv |
5RXI-O3A | data/5R/5RXI-O3A/5RXI-O3A_ligand.pdbqt | data/5R/5RXI-O3A/5RXI-O3A_target.pdbqt | data/5R/5RXI-O3A/5RXI-O3A_decoys.pdbqt | data/5R/5RXI-O3A/5RXI-O3A_decoy_scores.csv |
5RGY-UGS | data/5R/5RGY-UGS/5RGY-UGS_ligand.pdbqt | data/5R/5RGY-UGS/5RGY-UGS_target.pdbqt | data/5R/5RGY-UGS/5RGY-UGS_decoys.pdbqt | data/5R/5RGY-UGS/5RGY-UGS_decoy_scores.csv |
5RUY-XAN | data/5R/5RUY-XAN/5RUY-XAN_ligand.pdbqt | data/5R/5RUY-XAN/5RUY-XAN_target.pdbqt | data/5R/5RUY-XAN/5RUY-XAN_decoys.pdbqt | data/5R/5RUY-XAN/5RUY-XAN_decoy_scores.csv |
5RYH-WOA | data/5R/5RYH-WOA/5RYH-WOA_ligand.pdbqt | data/5R/5RYH-WOA/5RYH-WOA_target.pdbqt | data/5R/5RYH-WOA/5RYH-WOA_decoys.pdbqt | data/5R/5RYH-WOA/5RYH-WOA_decoy_scores.csv |
5R5X-RWV | data/5R/5R5X-RWV/5R5X-RWV_ligand.pdbqt | data/5R/5R5X-RWV/5R5X-RWV_target.pdbqt | data/5R/5R5X-RWV/5R5X-RWV_decoys.pdbqt | data/5R/5R5X-RWV/5R5X-RWV_decoy_scores.csv |
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