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 ⌀ |
|---|---|---|---|---|
1LID-OLA | data/1L/1LID-OLA/1LID-OLA_ligand.pdbqt | data/1L/1LID-OLA/1LID-OLA_target.pdbqt | data/1L/1LID-OLA/1LID-OLA_decoys.pdbqt | data/1L/1LID-OLA/1LID-OLA_decoy_scores.csv |
1LPB-MUP | data/1L/1LPB-MUP/1LPB-MUP_ligand.pdbqt | data/1L/1LPB-MUP/1LPB-MUP_target.pdbqt | data/1L/1LPB-MUP/1LPB-MUP_decoys.pdbqt | data/1L/1LPB-MUP/1LPB-MUP_decoy_scores.csv |
1L8G-DBD | data/1L/1L8G-DBD/1L8G-DBD_ligand.pdbqt | data/1L/1L8G-DBD/1L8G-DBD_target.pdbqt | data/1L/1L8G-DBD/1L8G-DBD_decoys.pdbqt | data/1L/1L8G-DBD/1L8G-DBD_decoy_scores.csv |
1LCB-TMP | data/1L/1LCB-TMP/1LCB-TMP_ligand.pdbqt | data/1L/1LCB-TMP/1LCB-TMP_target.pdbqt | data/1L/1LCB-TMP/1LCB-TMP_decoys.pdbqt | data/1L/1LCB-TMP/1LCB-TMP_decoy_scores.csv |
1LIH-PHN | data/1L/1LIH-PHN/1LIH-PHN_ligand.pdbqt | data/1L/1LIH-PHN/1LIH-PHN_target.pdbqt | data/1L/1LIH-PHN/1LIH-PHN_decoys.pdbqt | data/1L/1LIH-PHN/1LIH-PHN_decoy_scores.csv |
1L5R-RBF | data/1L/1L5R-RBF/1L5R-RBF_ligand.pdbqt | data/1L/1L5R-RBF/1L5R-RBF_target.pdbqt | data/1L/1L5R-RBF/1L5R-RBF_decoys.pdbqt | data/1L/1L5R-RBF/1L5R-RBF_decoy_scores.csv |
1LOJ-U | data/1L/1LOJ-U/1LOJ-U_ligand.pdbqt | data/1L/1LOJ-U/1LOJ-U_target.pdbqt | data/1L/1LOJ-U/1LOJ-U_decoys.pdbqt | data/1L/1LOJ-U/1LOJ-U_decoy_scores.csv |
1LL9-AXL | data/1L/1LL9-AXL/1LL9-AXL_ligand.pdbqt | data/1L/1LL9-AXL/1LL9-AXL_target.pdbqt | data/1L/1LL9-AXL/1LL9-AXL_decoys.pdbqt | data/1L/1LL9-AXL/1LL9-AXL_decoy_scores.csv |
1LLQ-NAD | data/1L/1LLQ-NAD/1LLQ-NAD_ligand.pdbqt | data/1L/1LLQ-NAD/1LLQ-NAD_target.pdbqt | data/1L/1LLQ-NAD/1LLQ-NAD_decoys.pdbqt | data/1L/1LLQ-NAD/1LLQ-NAD_decoy_scores.csv |
1LK7-DER | data/1L/1LK7-DER/1LK7-DER_ligand.pdbqt | data/1L/1LK7-DER/1LK7-DER_target.pdbqt | data/1L/1LK7-DER/1LK7-DER_decoys.pdbqt | data/1L/1LK7-DER/1LK7-DER_decoy_scores.csv |
1L3I-SAH | data/1L/1L3I-SAH/1L3I-SAH_ligand.pdbqt | data/1L/1L3I-SAH/1L3I-SAH_target.pdbqt | data/1L/1L3I-SAH/1L3I-SAH_decoys.pdbqt | data/1L/1L3I-SAH/1L3I-SAH_decoy_scores.csv |
1LNF-LYS | data/1L/1LNF-LYS/1LNF-LYS_ligand.pdbqt | data/1L/1LNF-LYS/1LNF-LYS_target.pdbqt | data/1L/1LNF-LYS/1LNF-LYS_decoys.pdbqt | data/1L/1LNF-LYS/1LNF-LYS_decoy_scores.csv |
1LON-GDP | data/1L/1LON-GDP/1LON-GDP_ligand.pdbqt | data/1L/1LON-GDP/1LON-GDP_target.pdbqt | data/1L/1LON-GDP/1LON-GDP_decoys.pdbqt | data/1L/1LON-GDP/1LON-GDP_decoy_scores.csv |
1L6G-PDD | data/1L/1L6G-PDD/1L6G-PDD_ligand.pdbqt | data/1L/1L6G-PDD/1L6G-PDD_target.pdbqt | data/1L/1L6G-PDD/1L6G-PDD_decoys.pdbqt | data/1L/1L6G-PDD/1L6G-PDD_decoy_scores.csv |
1LBB-KAI | data/1L/1LBB-KAI/1LBB-KAI_ligand.pdbqt | data/1L/1LBB-KAI/1LBB-KAI_target.pdbqt | data/1L/1LBB-KAI/1LBB-KAI_decoys.pdbqt | data/1L/1LBB-KAI/1LBB-KAI_decoy_scores.csv |
1L1R-9DA | data/1L/1L1R-9DA/1L1R-9DA_ligand.pdbqt | data/1L/1L1R-9DA/1L1R-9DA_target.pdbqt | data/1L/1L1R-9DA/1L1R-9DA_decoys.pdbqt | data/1L/1L1R-9DA/1L1R-9DA_decoy_scores.csv |
1L7X-NBG | data/1L/1L7X-NBG/1L7X-NBG_ligand.pdbqt | data/1L/1L7X-NBG/1L7X-NBG_target.pdbqt | data/1L/1L7X-NBG/1L7X-NBG_decoys.pdbqt | data/1L/1L7X-NBG/1L7X-NBG_decoy_scores.csv |
1LRT-TAD | data/1L/1LRT-TAD/1LRT-TAD_ligand.pdbqt | data/1L/1LRT-TAD/1LRT-TAD_target.pdbqt | data/1L/1LRT-TAD/1LRT-TAD_decoys.pdbqt | data/1L/1LRT-TAD/1LRT-TAD_decoy_scores.csv |
1LGH-DET | data/1L/1LGH-DET/1LGH-DET_ligand.pdbqt | data/1L/1LGH-DET/1LGH-DET_target.pdbqt | data/1L/1LGH-DET/1LGH-DET_decoys.pdbqt | data/1L/1LGH-DET/1LGH-DET_decoy_scores.csv |
1LAG-HIS | data/1L/1LAG-HIS/1LAG-HIS_ligand.pdbqt | data/1L/1LAG-HIS/1LAG-HIS_target.pdbqt | data/1L/1LAG-HIS/1LAG-HIS_decoys.pdbqt | data/1L/1LAG-HIS/1LAG-HIS_decoy_scores.csv |
1L5Q-700 | data/1L/1L5Q-700/1L5Q-700_ligand.pdbqt | data/1L/1L5Q-700/1L5Q-700_target.pdbqt | data/1L/1L5Q-700/1L5Q-700_decoys.pdbqt | data/1L/1L5Q-700/1L5Q-700_decoy_scores.csv |
1LOO-GTP | data/1L/1LOO-GTP/1LOO-GTP_ligand.pdbqt | data/1L/1LOO-GTP/1LOO-GTP_target.pdbqt | data/1L/1LOO-GTP/1LOO-GTP_decoys.pdbqt | data/1L/1LOO-GTP/1LOO-GTP_decoy_scores.csv |
1LVK-MNT | data/1L/1LVK-MNT/1LVK-MNT_ligand.pdbqt | data/1L/1LVK-MNT/1LVK-MNT_target.pdbqt | null | null |
1LNA-LYS | data/1L/1LNA-LYS/1LNA-LYS_ligand.pdbqt | data/1L/1LNA-LYS/1LNA-LYS_target.pdbqt | data/1L/1LNA-LYS/1LNA-LYS_decoys.pdbqt | data/1L/1LNA-LYS/1LNA-LYS_decoy_scores.csv |
1L5K-1RB | data/1L/1L5K-1RB/1L5K-1RB_ligand.pdbqt | data/1L/1L5K-1RB/1L5K-1RB_target.pdbqt | data/1L/1L5K-1RB/1L5K-1RB_decoys.pdbqt | data/1L/1L5K-1RB/1L5K-1RB_decoy_scores.csv |
1LC8-33P | data/1L/1LC8-33P/1LC8-33P_ligand.pdbqt | data/1L/1LC8-33P/1LC8-33P_target.pdbqt | data/1L/1LC8-33P/1LC8-33P_decoys.pdbqt | data/1L/1LC8-33P/1LC8-33P_decoy_scores.csv |
1LTQ-ADP | data/1L/1LTQ-ADP/1LTQ-ADP_ligand.pdbqt | data/1L/1LTQ-ADP/1LTQ-ADP_target.pdbqt | data/1L/1LTQ-ADP/1LTQ-ADP_decoys.pdbqt | data/1L/1LTQ-ADP/1LTQ-ADP_decoy_scores.csv |
1LCE-TMF | data/1L/1LCE-TMF/1LCE-TMF_ligand.pdbqt | data/1L/1LCE-TMF/1LCE-TMF_target.pdbqt | data/1L/1LCE-TMF/1LCE-TMF_decoys.pdbqt | data/1L/1LCE-TMF/1LCE-TMF_decoy_scores.csv |
1LND-LYS | data/1L/1LND-LYS/1LND-LYS_ligand.pdbqt | data/1L/1LND-LYS/1LND-LYS_target.pdbqt | data/1L/1LND-LYS/1LND-LYS_decoys.pdbqt | data/1L/1LND-LYS/1LND-LYS_decoy_scores.csv |
1LNM-DTX | data/1L/1LNM-DTX/1LNM-DTX_ligand.pdbqt | data/1L/1LNM-DTX/1LNM-DTX_target.pdbqt | data/1L/1LNM-DTX/1LNM-DTX_decoys.pdbqt | data/1L/1LNM-DTX/1LNM-DTX_decoy_scores.csv |
1L4F-150 | data/1L/1L4F-150/1L4F-150_ligand.pdbqt | data/1L/1L4F-150/1L4F-150_target.pdbqt | data/1L/1L4F-150/1L4F-150_decoys.pdbqt | data/1L/1L4F-150/1L4F-150_decoy_scores.csv |
1LTM-BCN | data/1L/1LTM-BCN/1LTM-BCN_ligand.pdbqt | data/1L/1LTM-BCN/1LTM-BCN_target.pdbqt | data/1L/1LTM-BCN/1LTM-BCN_decoys.pdbqt | data/1L/1LTM-BCN/1LTM-BCN_decoy_scores.csv |
1L4G-NCN | data/1L/1L4G-NCN/1L4G-NCN_ligand.pdbqt | data/1L/1L4G-NCN/1L4G-NCN_target.pdbqt | data/1L/1L4G-NCN/1L4G-NCN_decoys.pdbqt | data/1L/1L4G-NCN/1L4G-NCN_decoy_scores.csv |
1LFW-AEP | data/1L/1LFW-AEP/1LFW-AEP_ligand.pdbqt | data/1L/1LFW-AEP/1LFW-AEP_target.pdbqt | data/1L/1LFW-AEP/1LFW-AEP_decoys.pdbqt | data/1L/1LFW-AEP/1LFW-AEP_decoy_scores.csv |
1L4F-NCN | data/1L/1L4F-NCN/1L4F-NCN_ligand.pdbqt | data/1L/1L4F-NCN/1L4F-NCN_target.pdbqt | data/1L/1L4F-NCN/1L4F-NCN_decoys.pdbqt | data/1L/1L4F-NCN/1L4F-NCN_decoy_scores.csv |
1LC3-NAD | data/1L/1LC3-NAD/1LC3-NAD_ligand.pdbqt | data/1L/1LC3-NAD/1LC3-NAD_target.pdbqt | data/1L/1LC3-NAD/1LC3-NAD_decoys.pdbqt | data/1L/1LC3-NAD/1LC3-NAD_decoy_scores.csv |
1LF5-GDP | data/1L/1LF5-GDP/1LF5-GDP_ligand.pdbqt | data/1L/1LF5-GDP/1LF5-GDP_target.pdbqt | data/1L/1LF5-GDP/1LF5-GDP_decoys.pdbqt | data/1L/1LF5-GDP/1LF5-GDP_decoy_scores.csv |
1LOQ-U | data/1L/1LOQ-U/1LOQ-U_ligand.pdbqt | data/1L/1LOQ-U/1LOQ-U_target.pdbqt | data/1L/1LOQ-U/1LOQ-U_decoys.pdbqt | data/1L/1LOQ-U/1LOQ-U_decoy_scores.csv |
1L1E-SAH | data/1L/1L1E-SAH/1L1E-SAH_ligand.pdbqt | data/1L/1L1E-SAH/1L1E-SAH_target.pdbqt | data/1L/1L1E-SAH/1L1E-SAH_decoys.pdbqt | data/1L/1L1E-SAH/1L1E-SAH_decoy_scores.csv |
1LWO-CHI | data/1L/1LWO-CHI/1LWO-CHI_ligand.pdbqt | data/1L/1LWO-CHI/1LWO-CHI_target.pdbqt | data/1L/1LWO-CHI/1LWO-CHI_decoys.pdbqt | data/1L/1LWO-CHI/1LWO-CHI_decoy_scores.csv |
1L8T-ADP | data/1L/1L8T-ADP/1L8T-ADP_ligand.pdbqt | data/1L/1L8T-ADP/1L8T-ADP_target.pdbqt | data/1L/1L8T-ADP/1L8T-ADP_decoys.pdbqt | data/1L/1L8T-ADP/1L8T-ADP_decoy_scores.csv |
1LOD-MUR | data/1L/1LOD-MUR/1LOD-MUR_ligand.pdbqt | data/1L/1LOD-MUR/1LOD-MUR_target.pdbqt | data/1L/1LOD-MUR/1LOD-MUR_decoys.pdbqt | data/1L/1LOD-MUR/1LOD-MUR_decoy_scores.csv |
1LSL-FUL | data/1L/1LSL-FUL/1LSL-FUL_ligand.pdbqt | data/1L/1LSL-FUL/1LSL-FUL_target.pdbqt | data/1L/1LSL-FUL/1LSL-FUL_decoys.pdbqt | data/1L/1LSL-FUL/1LSL-FUL_decoy_scores.csv |
1LIJ-RPP | data/1L/1LIJ-RPP/1LIJ-RPP_ligand.pdbqt | data/1L/1LIJ-RPP/1LIJ-RPP_target.pdbqt | data/1L/1LIJ-RPP/1LIJ-RPP_decoys.pdbqt | data/1L/1LIJ-RPP/1LIJ-RPP_decoy_scores.csv |
1LPD-ADE | data/1L/1LPD-ADE/1LPD-ADE_ligand.pdbqt | data/1L/1LPD-ADE/1LPD-ADE_target.pdbqt | data/1L/1LPD-ADE/1LPD-ADE_decoys.pdbqt | data/1L/1LPD-ADE/1LPD-ADE_decoy_scores.csv |
1LW4-TLP | data/1L/1LW4-TLP/1LW4-TLP_ligand.pdbqt | data/1L/1LW4-TLP/1LW4-TLP_target.pdbqt | data/1L/1LW4-TLP/1LW4-TLP_decoys.pdbqt | data/1L/1LW4-TLP/1LW4-TLP_decoy_scores.csv |
1LP6-C5P | data/1L/1LP6-C5P/1LP6-C5P_ligand.pdbqt | data/1L/1LP6-C5P/1LP6-C5P_target.pdbqt | data/1L/1LP6-C5P/1LP6-C5P_decoys.pdbqt | data/1L/1LP6-C5P/1LP6-C5P_decoy_scores.csv |
1L0I-PSR | data/1L/1L0I-PSR/1L0I-PSR_ligand.pdbqt | data/1L/1L0I-PSR/1L0I-PSR_target.pdbqt | data/1L/1L0I-PSR/1L0I-PSR_decoys.pdbqt | data/1L/1L0I-PSR/1L0I-PSR_decoy_scores.csv |
1LQE-IMA | data/1L/1LQE-IMA/1LQE-IMA_ligand.pdbqt | data/1L/1LQE-IMA/1LQE-IMA_target.pdbqt | data/1L/1LQE-IMA/1LQE-IMA_decoys.pdbqt | data/1L/1LQE-IMA/1LQE-IMA_decoy_scores.csv |
1LWX-AZD | data/1L/1LWX-AZD/1LWX-AZD_ligand.pdbqt | data/1L/1LWX-AZD/1LWX-AZD_target.pdbqt | data/1L/1LWX-AZD/1LWX-AZD_decoys.pdbqt | data/1L/1LWX-AZD/1LWX-AZD_decoy_scores.csv |
1LCE-UMP | data/1L/1LCE-UMP/1LCE-UMP_ligand.pdbqt | data/1L/1LCE-UMP/1LCE-UMP_target.pdbqt | data/1L/1LCE-UMP/1LCE-UMP_decoys.pdbqt | data/1L/1LCE-UMP/1LCE-UMP_decoy_scores.csv |
1LCZ-BH7 | data/1L/1LCZ-BH7/1LCZ-BH7_ligand.pdbqt | data/1L/1LCZ-BH7/1LCZ-BH7_target.pdbqt | data/1L/1LCZ-BH7/1LCZ-BH7_decoys.pdbqt | data/1L/1LCZ-BH7/1LCZ-BH7_decoy_scores.csv |
1L4H-NCN | data/1L/1L4H-NCN/1L4H-NCN_ligand.pdbqt | data/1L/1L4H-NCN/1L4H-NCN_target.pdbqt | data/1L/1L4H-NCN/1L4H-NCN_decoys.pdbqt | data/1L/1L4H-NCN/1L4H-NCN_decoy_scores.csv |
1LH0-PRP | data/1L/1LH0-PRP/1LH0-PRP_ligand.pdbqt | data/1L/1LH0-PRP/1LH0-PRP_target.pdbqt | data/1L/1LH0-PRP/1LH0-PRP_decoys.pdbqt | data/1L/1LH0-PRP/1LH0-PRP_decoy_scores.csv |
1LRT-IMP | data/1L/1LRT-IMP/1LRT-IMP_ligand.pdbqt | data/1L/1LRT-IMP/1LRT-IMP_target.pdbqt | data/1L/1LRT-IMP/1LRT-IMP_decoys.pdbqt | data/1L/1LRT-IMP/1LRT-IMP_decoy_scores.csv |
1LP4-ANP | data/1L/1LP4-ANP/1LP4-ANP_ligand.pdbqt | data/1L/1LP4-ANP/1LP4-ANP_target.pdbqt | data/1L/1LP4-ANP/1LP4-ANP_decoys.pdbqt | data/1L/1LP4-ANP/1LP4-ANP_decoy_scores.csv |
1LKD-P6G | data/1L/1LKD-P6G/1LKD-P6G_ligand.pdbqt | data/1L/1LKD-P6G/1LKD-P6G_target.pdbqt | data/1L/1LKD-P6G/1LKD-P6G_decoys.pdbqt | data/1L/1LKD-P6G/1LKD-P6G_decoy_scores.csv |
1LRI-CLR | data/1L/1LRI-CLR/1LRI-CLR_ligand.pdbqt | data/1L/1LRI-CLR/1LRI-CLR_target.pdbqt | data/1L/1LRI-CLR/1LRI-CLR_decoys.pdbqt | data/1L/1LRI-CLR/1LRI-CLR_decoy_scores.csv |
1L8B-MGP | data/1L/1L8B-MGP/1L8B-MGP_ligand.pdbqt | data/1L/1L8B-MGP/1L8B-MGP_target.pdbqt | data/1L/1L8B-MGP/1L8B-MGP_decoys.pdbqt | data/1L/1L8B-MGP/1L8B-MGP_decoy_scores.csv |
1LLR-LNQ | data/1L/1LLR-LNQ/1LLR-LNQ_ligand.pdbqt | data/1L/1LLR-LNQ/1LLR-LNQ_target.pdbqt | data/1L/1LLR-LNQ/1LLR-LNQ_decoys.pdbqt | data/1L/1LLR-LNQ/1LLR-LNQ_decoy_scores.csv |
1LZX-HAR | data/1L/1LZX-HAR/1LZX-HAR_ligand.pdbqt | data/1L/1LZX-HAR/1LZX-HAR_target.pdbqt | data/1L/1LZX-HAR/1LZX-HAR_decoys.pdbqt | data/1L/1LZX-HAR/1LZX-HAR_decoy_scores.csv |
1LPC-CMP | data/1L/1LPC-CMP/1LPC-CMP_ligand.pdbqt | data/1L/1LPC-CMP/1LPC-CMP_target.pdbqt | data/1L/1LPC-CMP/1LPC-CMP_decoys.pdbqt | data/1L/1LPC-CMP/1LPC-CMP_decoy_scores.csv |
1L6M-DBH | data/1L/1L6M-DBH/1L6M-DBH_ligand.pdbqt | data/1L/1L6M-DBH/1L6M-DBH_target.pdbqt | data/1L/1L6M-DBH/1L6M-DBH_decoys.pdbqt | data/1L/1L6M-DBH/1L6M-DBH_decoy_scores.csv |
1LGH-LYC | data/1L/1LGH-LYC/1LGH-LYC_ligand.pdbqt | data/1L/1LGH-LYC/1LGH-LYC_target.pdbqt | data/1L/1LGH-LYC/1LGH-LYC_decoys.pdbqt | data/1L/1LGH-LYC/1LGH-LYC_decoy_scores.csv |
1L7E-NAI | data/1L/1L7E-NAI/1L7E-NAI_ligand.pdbqt | data/1L/1L7E-NAI/1L7E-NAI_target.pdbqt | data/1L/1L7E-NAI/1L7E-NAI_decoys.pdbqt | data/1L/1L7E-NAI/1L7E-NAI_decoy_scores.csv |
1LIF-STE | data/1L/1LIF-STE/1LIF-STE_ligand.pdbqt | data/1L/1LIF-STE/1LIF-STE_target.pdbqt | data/1L/1LIF-STE/1LIF-STE_decoys.pdbqt | data/1L/1LIF-STE/1LIF-STE_decoy_scores.csv |
1L7K-GLA | data/1L/1L7K-GLA/1L7K-GLA_ligand.pdbqt | data/1L/1L7K-GLA/1L7K-GLA_target.pdbqt | data/1L/1L7K-GLA/1L7K-GLA_decoys.pdbqt | data/1L/1L7K-GLA/1L7K-GLA_decoy_scores.csv |
1LRJ-UD1 | data/1L/1LRJ-UD1/1LRJ-UD1_ligand.pdbqt | data/1L/1LRJ-UD1/1LRJ-UD1_target.pdbqt | data/1L/1LRJ-UD1/1LRJ-UD1_decoys.pdbqt | data/1L/1LRJ-UD1/1LRJ-UD1_decoy_scores.csv |
1LPZ-CMB | data/1L/1LPZ-CMB/1LPZ-CMB_ligand.pdbqt | data/1L/1LPZ-CMB/1LPZ-CMB_target.pdbqt | data/1L/1LPZ-CMB/1LPZ-CMB_decoys.pdbqt | data/1L/1LPZ-CMB/1LPZ-CMB_decoy_scores.csv |
1LL5-IM2 | data/1L/1LL5-IM2/1LL5-IM2_ligand.pdbqt | data/1L/1LL5-IM2/1LL5-IM2_target.pdbqt | data/1L/1LL5-IM2/1LL5-IM2_decoys.pdbqt | data/1L/1LL5-IM2/1LL5-IM2_decoy_scores.csv |
3MHY-ATP | data/3M/3MHY-ATP/3MHY-ATP_ligand.pdbqt | data/3M/3MHY-ATP/3MHY-ATP_target.pdbqt | data/3M/3MHY-ATP/3MHY-ATP_decoys.pdbqt | data/3M/3MHY-ATP/3MHY-ATP_decoy_scores.csv |
3M7O-BEN | data/3M/3M7O-BEN/3M7O-BEN_ligand.pdbqt | data/3M/3M7O-BEN/3M7O-BEN_target.pdbqt | data/3M/3M7O-BEN/3M7O-BEN_decoys.pdbqt | data/3M/3M7O-BEN/3M7O-BEN_decoy_scores.csv |
3MS7-22S | data/3M/3MS7-22S/3MS7-22S_ligand.pdbqt | data/3M/3MS7-22S/3MS7-22S_target.pdbqt | data/3M/3MS7-22S/3MS7-22S_decoys.pdbqt | data/3M/3MS7-22S/3MS7-22S_decoy_scores.csv |
3MT7-16O | data/3M/3MT7-16O/3MT7-16O_ligand.pdbqt | data/3M/3MT7-16O/3MT7-16O_target.pdbqt | data/3M/3MT7-16O/3MT7-16O_decoys.pdbqt | data/3M/3MT7-16O/3MT7-16O_decoy_scores.csv |
3M37-M37 | data/3M/3M37-M37/3M37-M37_ligand.pdbqt | data/3M/3M37-M37/3M37-M37_target.pdbqt | data/3M/3M37-M37/3M37-M37_decoys.pdbqt | data/3M/3M37-M37/3M37-M37_decoy_scores.csv |
3MYQ-E27 | data/3M/3MYQ-E27/3MYQ-E27_ligand.pdbqt | data/3M/3MYQ-E27/3MYQ-E27_target.pdbqt | data/3M/3MYQ-E27/3MYQ-E27_decoys.pdbqt | data/3M/3MYQ-E27/3MYQ-E27_decoy_scores.csv |
3M35-M35 | data/3M/3M35-M35/3M35-M35_ligand.pdbqt | data/3M/3M35-M35/3M35-M35_target.pdbqt | data/3M/3M35-M35/3M35-M35_decoys.pdbqt | data/3M/3M35-M35/3M35-M35_decoy_scores.csv |
3ME3-3SZ | data/3M/3ME3-3SZ/3ME3-3SZ_ligand.pdbqt | data/3M/3ME3-3SZ/3ME3-3SZ_target.pdbqt | data/3M/3ME3-3SZ/3ME3-3SZ_decoys.pdbqt | data/3M/3ME3-3SZ/3ME3-3SZ_decoy_scores.csv |
3M2W-L8I | data/3M/3M2W-L8I/3M2W-L8I_ligand.pdbqt | data/3M/3M2W-L8I/3M2W-L8I_target.pdbqt | data/3M/3M2W-L8I/3M2W-L8I_decoys.pdbqt | data/3M/3M2W-L8I/3M2W-L8I_decoy_scores.csv |
3ME3-FBP | data/3M/3ME3-FBP/3ME3-FBP_ligand.pdbqt | data/3M/3ME3-FBP/3ME3-FBP_target.pdbqt | data/3M/3ME3-FBP/3ME3-FBP_decoys.pdbqt | data/3M/3ME3-FBP/3ME3-FBP_decoy_scores.csv |
3MTB-23V | data/3M/3MTB-23V/3MTB-23V_ligand.pdbqt | data/3M/3MTB-23V/3MTB-23V_target.pdbqt | data/3M/3MTB-23V/3MTB-23V_decoys.pdbqt | data/3M/3MTB-23V/3MTB-23V_decoy_scores.csv |
3MWK-8OP | data/3M/3MWK-8OP/3MWK-8OP_ligand.pdbqt | data/3M/3MWK-8OP/3MWK-8OP_target.pdbqt | data/3M/3MWK-8OP/3MWK-8OP_decoys.pdbqt | data/3M/3MWK-8OP/3MWK-8OP_decoy_scores.csv |
3M8B-MTN | data/3M/3M8B-MTN/3M8B-MTN_ligand.pdbqt | data/3M/3M8B-MTN/3M8B-MTN_target.pdbqt | data/3M/3M8B-MTN/3M8B-MTN_decoys.pdbqt | data/3M/3M8B-MTN/3M8B-MTN_decoy_scores.csv |
3M04-BE9 | data/3M/3M04-BE9/3M04-BE9_ligand.pdbqt | data/3M/3M04-BE9/3M04-BE9_target.pdbqt | data/3M/3M04-BE9/3M04-BE9_decoys.pdbqt | data/3M/3M04-BE9/3M04-BE9_decoy_scores.csv |
3MQG-PE4 | data/3M/3MQG-PE4/3MQG-PE4_ligand.pdbqt | data/3M/3MQG-PE4/3MQG-PE4_target.pdbqt | data/3M/3MQG-PE4/3MQG-PE4_decoys.pdbqt | data/3M/3MQG-PE4/3MQG-PE4_decoy_scores.csv |
3MO2-E67 | data/3M/3MO2-E67/3MO2-E67_ligand.pdbqt | data/3M/3MO2-E67/3MO2-E67_target.pdbqt | data/3M/3MO2-E67/3MO2-E67_decoys.pdbqt | data/3M/3MO2-E67/3MO2-E67_decoy_scores.csv |
3MG3-ECH | data/3M/3MG3-ECH/3MG3-ECH_ligand.pdbqt | data/3M/3MG3-ECH/3MG3-ECH_target.pdbqt | data/3M/3MG3-ECH/3MG3-ECH_decoys.pdbqt | data/3M/3MG3-ECH/3MG3-ECH_decoy_scores.csv |
3MVY-BHZ | data/3M/3MVY-BHZ/3MVY-BHZ_ligand.pdbqt | data/3M/3MVY-BHZ/3MVY-BHZ_target.pdbqt | data/3M/3MVY-BHZ/3MVY-BHZ_decoys.pdbqt | data/3M/3MVY-BHZ/3MVY-BHZ_decoy_scores.csv |
3MOF-GTP | data/3M/3MOF-GTP/3MOF-GTP_ligand.pdbqt | data/3M/3MOF-GTP/3MOF-GTP_target.pdbqt | data/3M/3MOF-GTP/3MOF-GTP_decoys.pdbqt | data/3M/3MOF-GTP/3MOF-GTP_decoy_scores.csv |
3M3F-GLU | data/3M/3M3F-GLU/3M3F-GLU_ligand.pdbqt | data/3M/3M3F-GLU/3M3F-GLU_target.pdbqt | data/3M/3M3F-GLU/3M3F-GLU_decoys.pdbqt | data/3M/3M3F-GLU/3M3F-GLU_decoy_scores.csv |
3MDZ-EZL | data/3M/3MDZ-EZL/3MDZ-EZL_ligand.pdbqt | data/3M/3MDZ-EZL/3MDZ-EZL_target.pdbqt | data/3M/3MDZ-EZL/3MDZ-EZL_decoys.pdbqt | data/3M/3MDZ-EZL/3MDZ-EZL_decoy_scores.csv |
3MHU-EJZ | data/3M/3MHU-EJZ/3MHU-EJZ_ligand.pdbqt | data/3M/3MHU-EJZ/3MHU-EJZ_target.pdbqt | data/3M/3MHU-EJZ/3MHU-EJZ_decoys.pdbqt | data/3M/3MHU-EJZ/3MHU-EJZ_decoy_scores.csv |
3MN5-LAB | data/3M/3MN5-LAB/3MN5-LAB_ligand.pdbqt | data/3M/3MN5-LAB/3MN5-LAB_target.pdbqt | data/3M/3MN5-LAB/3MN5-LAB_decoys.pdbqt | data/3M/3MN5-LAB/3MN5-LAB_decoy_scores.csv |
3MCO-PH2 | data/3M/3MCO-PH2/3MCO-PH2_ligand.pdbqt | data/3M/3MCO-PH2/3MCO-PH2_target.pdbqt | data/3M/3MCO-PH2/3MCO-PH2_decoys.pdbqt | data/3M/3MCO-PH2/3MCO-PH2_decoy_scores.csv |
3MHW-ABV | data/3M/3MHW-ABV/3MHW-ABV_ligand.pdbqt | data/3M/3MHW-ABV/3MHW-ABV_target.pdbqt | data/3M/3MHW-ABV/3MHW-ABV_decoys.pdbqt | data/3M/3MHW-ABV/3MHW-ABV_decoy_scores.csv |
3MOH-GDP | data/3M/3MOH-GDP/3MOH-GDP_ligand.pdbqt | data/3M/3MOH-GDP/3MOH-GDP_target.pdbqt | data/3M/3MOH-GDP/3MOH-GDP_decoys.pdbqt | data/3M/3MOH-GDP/3MOH-GDP_decoy_scores.csv |
3M14-BEV | data/3M/3M14-BEV/3M14-BEV_ligand.pdbqt | data/3M/3M14-BEV/3M14-BEV_target.pdbqt | data/3M/3M14-BEV/3M14-BEV_decoys.pdbqt | data/3M/3M14-BEV/3M14-BEV_decoy_scores.csv |
3MX2-TTP | data/3M/3MX2-TTP/3MX2-TTP_ligand.pdbqt | data/3M/3MX2-TTP/3MX2-TTP_target.pdbqt | data/3M/3MX2-TTP/3MX2-TTP_decoys.pdbqt | data/3M/3MX2-TTP/3MX2-TTP_decoy_scores.csv |
3MPT-1GK | data/3M/3MPT-1GK/3MPT-1GK_ligand.pdbqt | data/3M/3MPT-1GK/3MPT-1GK_target.pdbqt | data/3M/3MPT-1GK/3MPT-1GK_decoys.pdbqt | data/3M/3MPT-1GK/3MPT-1GK_decoy_scores.csv |
3MA0-XYP | data/3M/3MA0-XYP/3MA0-XYP_ligand.pdbqt | data/3M/3MA0-XYP/3MA0-XYP_target.pdbqt | data/3M/3MA0-XYP/3MA0-XYP_decoys.pdbqt | data/3M/3MA0-XYP/3MA0-XYP_decoy_scores.csv |
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