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 ⌀ |
|---|---|---|---|---|
1GI6-124 | data/1G/1GI6-124/1GI6-124_ligand.pdbqt | data/1G/1GI6-124/1GI6-124_target.pdbqt | data/1G/1GI6-124/1GI6-124_decoys.pdbqt | data/1G/1GI6-124/1GI6-124_decoy_scores.csv |
1GTZ-DHK | data/1G/1GTZ-DHK/1GTZ-DHK_ligand.pdbqt | data/1G/1GTZ-DHK/1GTZ-DHK_target.pdbqt | data/1G/1GTZ-DHK/1GTZ-DHK_decoys.pdbqt | data/1G/1GTZ-DHK/1GTZ-DHK_decoy_scores.csv |
1GNR-CAG | data/1G/1GNR-CAG/1GNR-CAG_ligand.pdbqt | data/1G/1GNR-CAG/1GNR-CAG_target.pdbqt | data/1G/1GNR-CAG/1GNR-CAG_decoys.pdbqt | data/1G/1GNR-CAG/1GNR-CAG_decoy_scores.csv |
1GO6-DVC | data/1G/1GO6-DVC/1GO6-DVC_ligand.pdbqt | data/1G/1GO6-DVC/1GO6-DVC_target.pdbqt | data/1G/1GO6-DVC/1GO6-DVC_decoys.pdbqt | data/1G/1GO6-DVC/1GO6-DVC_decoy_scores.csv |
1GX0-GAL | data/1G/1GX0-GAL/1GX0-GAL_ligand.pdbqt | data/1G/1GX0-GAL/1GX0-GAL_target.pdbqt | data/1G/1GX0-GAL/1GX0-GAL_decoys.pdbqt | data/1G/1GX0-GAL/1GX0-GAL_decoy_scores.csv |
1G36-R11 | data/1G/1G36-R11/1G36-R11_ligand.pdbqt | data/1G/1G36-R11/1G36-R11_target.pdbqt | data/1G/1G36-R11/1G36-R11_decoys.pdbqt | data/1G/1G36-R11/1G36-R11_decoy_scores.csv |
1GVT-2ZS | data/1G/1GVT-2ZS/1GVT-2ZS_ligand.pdbqt | data/1G/1GVT-2ZS/1GVT-2ZS_target.pdbqt | data/1G/1GVT-2ZS/1GVT-2ZS_decoys.pdbqt | data/1G/1GVT-2ZS/1GVT-2ZS_decoy_scores.csv |
1GQK-BDP | data/1G/1GQK-BDP/1GQK-BDP_ligand.pdbqt | data/1G/1GQK-BDP/1GQK-BDP_target.pdbqt | data/1G/1GQK-BDP/1GQK-BDP_decoys.pdbqt | data/1G/1GQK-BDP/1GQK-BDP_decoy_scores.csv |
1GWW-GLC | data/1G/1GWW-GLC/1GWW-GLC_ligand.pdbqt | data/1G/1GWW-GLC/1GWW-GLC_target.pdbqt | data/1G/1GWW-GLC/1GWW-GLC_decoys.pdbqt | data/1G/1GWW-GLC/1GWW-GLC_decoy_scores.csv |
1GLG-GAL | data/1G/1GLG-GAL/1GLG-GAL_ligand.pdbqt | data/1G/1GLG-GAL/1GLG-GAL_target.pdbqt | data/1G/1GLG-GAL/1GLG-GAL_decoys.pdbqt | data/1G/1GLG-GAL/1GLG-GAL_decoy_scores.csv |
1G0I-INS | data/1G/1G0I-INS/1G0I-INS_ligand.pdbqt | data/1G/1G0I-INS/1G0I-INS_target.pdbqt | data/1G/1G0I-INS/1G0I-INS_decoys.pdbqt | data/1G/1G0I-INS/1G0I-INS_decoy_scores.csv |
1G6S-GPJ | data/1G/1G6S-GPJ/1G6S-GPJ_ligand.pdbqt | data/1G/1G6S-GPJ/1G6S-GPJ_target.pdbqt | data/1G/1G6S-GPJ/1G6S-GPJ_decoys.pdbqt | data/1G/1G6S-GPJ/1G6S-GPJ_decoy_scores.csv |
1GIQ-NAI | data/1G/1GIQ-NAI/1GIQ-NAI_ligand.pdbqt | data/1G/1GIQ-NAI/1GIQ-NAI_target.pdbqt | data/1G/1GIQ-NAI/1GIQ-NAI_decoys.pdbqt | data/1G/1GIQ-NAI/1GIQ-NAI_decoy_scores.csv |
1G0H-IPD | data/1G/1G0H-IPD/1G0H-IPD_ligand.pdbqt | data/1G/1G0H-IPD/1G0H-IPD_target.pdbqt | data/1G/1G0H-IPD/1G0H-IPD_decoys.pdbqt | data/1G/1G0H-IPD/1G0H-IPD_decoy_scores.csv |
1GT6-OLA | data/1G/1GT6-OLA/1GT6-OLA_ligand.pdbqt | data/1G/1GT6-OLA/1GT6-OLA_target.pdbqt | data/1G/1GT6-OLA/1GT6-OLA_decoys.pdbqt | data/1G/1GT6-OLA/1GT6-OLA_decoy_scores.csv |
1G7V-PAI | data/1G/1G7V-PAI/1G7V-PAI_ligand.pdbqt | data/1G/1G7V-PAI/1G7V-PAI_target.pdbqt | data/1G/1G7V-PAI/1G7V-PAI_decoys.pdbqt | data/1G/1G7V-PAI/1G7V-PAI_decoy_scores.csv |
1G64-ATP | data/1G/1G64-ATP/1G64-ATP_ligand.pdbqt | data/1G/1G64-ATP/1G64-ATP_target.pdbqt | data/1G/1G64-ATP/1G64-ATP_decoys.pdbqt | data/1G/1G64-ATP/1G64-ATP_decoy_scores.csv |
1GXZ-BRT | data/1G/1GXZ-BRT/1GXZ-BRT_ligand.pdbqt | data/1G/1GXZ-BRT/1GXZ-BRT_target.pdbqt | data/1G/1GXZ-BRT/1GXZ-BRT_decoys.pdbqt | data/1G/1GXZ-BRT/1GXZ-BRT_decoy_scores.csv |
1GNM-U0E | data/1G/1GNM-U0E/1GNM-U0E_ligand.pdbqt | data/1G/1GNM-U0E/1GNM-U0E_target.pdbqt | data/1G/1GNM-U0E/1GNM-U0E_decoys.pdbqt | data/1G/1GNM-U0E/1GNM-U0E_decoy_scores.csv |
1GWT-FER | data/1G/1GWT-FER/1GWT-FER_ligand.pdbqt | data/1G/1GWT-FER/1GWT-FER_target.pdbqt | data/1G/1GWT-FER/1GWT-FER_decoys.pdbqt | data/1G/1GWT-FER/1GWT-FER_decoy_scores.csv |
1GAD-NAD | data/1G/1GAD-NAD/1GAD-NAD_ligand.pdbqt | data/1G/1GAD-NAD/1GAD-NAD_target.pdbqt | data/1G/1GAD-NAD/1GAD-NAD_decoys.pdbqt | data/1G/1GAD-NAD/1GAD-NAD_decoy_scores.csv |
1GW9-LXC | data/1G/1GW9-LXC/1GW9-LXC_ligand.pdbqt | data/1G/1GW9-LXC/1GW9-LXC_target.pdbqt | data/1G/1GW9-LXC/1GW9-LXC_decoys.pdbqt | data/1G/1GW9-LXC/1GW9-LXC_decoy_scores.csv |
1G9B-BAB | data/1G/1G9B-BAB/1G9B-BAB_ligand.pdbqt | data/1G/1G9B-BAB/1G9B-BAB_target.pdbqt | data/1G/1G9B-BAB/1G9B-BAB_decoys.pdbqt | data/1G/1G9B-BAB/1G9B-BAB_decoy_scores.csv |
1GP2-GDP | data/1G/1GP2-GDP/1GP2-GDP_ligand.pdbqt | data/1G/1GP2-GDP/1GP2-GDP_target.pdbqt | data/1G/1GP2-GDP/1GP2-GDP_decoys.pdbqt | data/1G/1GP2-GDP/1GP2-GDP_decoy_scores.csv |
1G3E-109 | data/1G/1G3E-109/1G3E-109_ligand.pdbqt | data/1G/1G3E-109/1G3E-109_target.pdbqt | data/1G/1G3E-109/1G3E-109_decoys.pdbqt | data/1G/1G3E-109/1G3E-109_decoy_scores.csv |
1G51-AMP | data/1G/1G51-AMP/1G51-AMP_ligand.pdbqt | data/1G/1G51-AMP/1G51-AMP_target.pdbqt | data/1G/1G51-AMP/1G51-AMP_decoys.pdbqt | data/1G/1G51-AMP/1G51-AMP_decoy_scores.csv |
1GP6-QUE | data/1G/1GP6-QUE/1GP6-QUE_ligand.pdbqt | data/1G/1GP6-QUE/1GP6-QUE_target.pdbqt | data/1G/1GP6-QUE/1GP6-QUE_decoys.pdbqt | data/1G/1GP6-QUE/1GP6-QUE_decoy_scores.csv |
1G3D-108 | data/1G/1G3D-108/1G3D-108_ligand.pdbqt | data/1G/1G3D-108/1G3D-108_target.pdbqt | data/1G/1G3D-108/1G3D-108_decoys.pdbqt | data/1G/1G3D-108/1G3D-108_decoy_scores.csv |
1GMP-2GP | data/1G/1GMP-2GP/1GMP-2GP_ligand.pdbqt | data/1G/1GMP-2GP/1GMP-2GP_target.pdbqt | data/1G/1GMP-2GP/1GMP-2GP_decoys.pdbqt | data/1G/1GMP-2GP/1GMP-2GP_decoy_scores.csv |
1GSU-GTX | data/1G/1GSU-GTX/1GSU-GTX_ligand.pdbqt | data/1G/1GSU-GTX/1GSU-GTX_target.pdbqt | data/1G/1GSU-GTX/1GSU-GTX_decoys.pdbqt | data/1G/1GSU-GTX/1GSU-GTX_decoy_scores.csv |
1G6S-S3P | data/1G/1G6S-S3P/1G6S-S3P_ligand.pdbqt | data/1G/1G6S-S3P/1G6S-S3P_target.pdbqt | data/1G/1G6S-S3P/1G6S-S3P_decoys.pdbqt | data/1G/1G6S-S3P/1G6S-S3P_decoy_scores.csv |
1G0R-G1P | data/1G/1G0R-G1P/1G0R-G1P_ligand.pdbqt | data/1G/1G0R-G1P/1G0R-G1P_target.pdbqt | data/1G/1G0R-G1P/1G0R-G1P_decoys.pdbqt | data/1G/1G0R-G1P/1G0R-G1P_decoy_scores.csv |
1GZF-NAD | data/1G/1GZF-NAD/1GZF-NAD_ligand.pdbqt | data/1G/1GZF-NAD/1GZF-NAD_target.pdbqt | data/1G/1GZF-NAD/1GZF-NAD_decoys.pdbqt | data/1G/1GZF-NAD/1GZF-NAD_decoy_scores.csv |
1G41-ADP | data/1G/1G41-ADP/1G41-ADP_ligand.pdbqt | data/1G/1G41-ADP/1G41-ADP_target.pdbqt | data/1G/1G41-ADP/1G41-ADP_decoys.pdbqt | data/1G/1G41-ADP/1G41-ADP_decoy_scores.csv |
1G99-ADP | data/1G/1G99-ADP/1G99-ADP_ligand.pdbqt | data/1G/1G99-ADP/1G99-ADP_target.pdbqt | data/1G/1G99-ADP/1G99-ADP_decoys.pdbqt | data/1G/1G99-ADP/1G99-ADP_decoy_scores.csv |
1G16-GDP | data/1G/1G16-GDP/1G16-GDP_ligand.pdbqt | data/1G/1G16-GDP/1G16-GDP_target.pdbqt | data/1G/1G16-GDP/1G16-GDP_decoys.pdbqt | data/1G/1G16-GDP/1G16-GDP_decoy_scores.csv |
1GQR-SAF | data/1G/1GQR-SAF/1GQR-SAF_ligand.pdbqt | data/1G/1GQR-SAF/1GQR-SAF_target.pdbqt | data/1G/1GQR-SAF/1GQR-SAF_decoys.pdbqt | data/1G/1GQR-SAF/1GQR-SAF_decoy_scores.csv |
1GIC-GYP | data/1G/1GIC-GYP/1GIC-GYP_ligand.pdbqt | data/1G/1GIC-GYP/1GIC-GYP_target.pdbqt | data/1G/1GIC-GYP/1GIC-GYP_decoys.pdbqt | data/1G/1GIC-GYP/1GIC-GYP_decoy_scores.csv |
1GT5-BZQ | data/1G/1GT5-BZQ/1GT5-BZQ_ligand.pdbqt | data/1G/1GT5-BZQ/1GT5-BZQ_target.pdbqt | data/1G/1GT5-BZQ/1GT5-BZQ_decoys.pdbqt | data/1G/1GT5-BZQ/1GT5-BZQ_decoy_scores.csv |
1GZQ-D12 | data/1G/1GZQ-D12/1GZQ-D12_ligand.pdbqt | data/1G/1GZQ-D12/1GZQ-D12_target.pdbqt | data/1G/1GZQ-D12/1GZQ-D12_decoys.pdbqt | data/1G/1GZQ-D12/1GZQ-D12_decoy_scores.csv |
1GXW-LYS | data/1G/1GXW-LYS/1GXW-LYS_ligand.pdbqt | data/1G/1GXW-LYS/1GXW-LYS_target.pdbqt | data/1G/1GXW-LYS/1GXW-LYS_decoys.pdbqt | data/1G/1GXW-LYS/1GXW-LYS_decoy_scores.csv |
1GI0-BMZ | data/1G/1GI0-BMZ/1GI0-BMZ_ligand.pdbqt | data/1G/1GI0-BMZ/1GI0-BMZ_target.pdbqt | data/1G/1GI0-BMZ/1GI0-BMZ_decoys.pdbqt | data/1G/1GI0-BMZ/1GI0-BMZ_decoy_scores.csv |
1GOJ-ADP | data/1G/1GOJ-ADP/1GOJ-ADP_ligand.pdbqt | data/1G/1GOJ-ADP/1GOJ-ADP_target.pdbqt | data/1G/1GOJ-ADP/1GOJ-ADP_decoys.pdbqt | data/1G/1GOJ-ADP/1GOJ-ADP_decoy_scores.csv |
1G2K-NM1 | data/1G/1G2K-NM1/1G2K-NM1_ligand.pdbqt | data/1G/1G2K-NM1/1G2K-NM1_target.pdbqt | data/1G/1G2K-NM1/1G2K-NM1_decoys.pdbqt | data/1G/1G2K-NM1/1G2K-NM1_decoy_scores.csv |
1GG8-GLG | data/1G/1GG8-GLG/1GG8-GLG_ligand.pdbqt | data/1G/1GG8-GLG/1GG8-GLG_target.pdbqt | data/1G/1GG8-GLG/1GG8-GLG_decoys.pdbqt | data/1G/1GG8-GLG/1GG8-GLG_decoy_scores.csv |
1GSJ-NLG | data/1G/1GSJ-NLG/1GSJ-NLG_ligand.pdbqt | data/1G/1GSJ-NLG/1GSJ-NLG_target.pdbqt | data/1G/1GSJ-NLG/1GSJ-NLG_decoys.pdbqt | data/1G/1GSJ-NLG/1GSJ-NLG_decoy_scores.csv |
1GJ6-132 | data/1G/1GJ6-132/1GJ6-132_ligand.pdbqt | data/1G/1GJ6-132/1GJ6-132_target.pdbqt | data/1G/1GJ6-132/1GJ6-132_decoys.pdbqt | data/1G/1GJ6-132/1GJ6-132_decoy_scores.csv |
1GHB-TRP | data/1G/1GHB-TRP/1GHB-TRP_ligand.pdbqt | data/1G/1GHB-TRP/1GHB-TRP_target.pdbqt | data/1G/1GHB-TRP/1GHB-TRP_decoys.pdbqt | data/1G/1GHB-TRP/1GHB-TRP_decoy_scores.csv |
1GOT-GDP | data/1G/1GOT-GDP/1GOT-GDP_ligand.pdbqt | data/1G/1GOT-GDP/1GOT-GDP_target.pdbqt | data/1G/1GOT-GDP/1GOT-GDP_decoys.pdbqt | data/1G/1GOT-GDP/1GOT-GDP_decoy_scores.csv |
1GVO-FMN | data/1G/1GVO-FMN/1GVO-FMN_ligand.pdbqt | data/1G/1GVO-FMN/1GVO-FMN_target.pdbqt | data/1G/1GVO-FMN/1GVO-FMN_decoys.pdbqt | data/1G/1GVO-FMN/1GVO-FMN_decoy_scores.csv |
1GEY-PPE | data/1G/1GEY-PPE/1GEY-PPE_ligand.pdbqt | data/1G/1GEY-PPE/1GEY-PPE_target.pdbqt | data/1G/1GEY-PPE/1GEY-PPE_decoys.pdbqt | data/1G/1GEY-PPE/1GEY-PPE_decoy_scores.csv |
1GUA-GNP | data/1G/1GUA-GNP/1GUA-GNP_ligand.pdbqt | data/1G/1GUA-GNP/1GUA-GNP_target.pdbqt | data/1G/1GUA-GNP/1GUA-GNP_decoys.pdbqt | data/1G/1GUA-GNP/1GUA-GNP_decoy_scores.csv |
1GS5-NLG | data/1G/1GS5-NLG/1GS5-NLG_ligand.pdbqt | data/1G/1GS5-NLG/1GS5-NLG_target.pdbqt | data/1G/1GS5-NLG/1GS5-NLG_decoys.pdbqt | data/1G/1GS5-NLG/1GS5-NLG_decoy_scores.csv |
1GT1-ANC | data/1G/1GT1-ANC/1GT1-ANC_ligand.pdbqt | data/1G/1GT1-ANC/1GT1-ANC_target.pdbqt | data/1G/1GT1-ANC/1GT1-ANC_decoys.pdbqt | data/1G/1GT1-ANC/1GT1-ANC_decoy_scores.csv |
1GUE-RET | data/1G/1GUE-RET/1GUE-RET_ligand.pdbqt | data/1G/1GUE-RET/1GUE-RET_target.pdbqt | data/1G/1GUE-RET/1GUE-RET_decoys.pdbqt | data/1G/1GUE-RET/1GUE-RET_decoy_scores.csv |
1G4S-TPS | data/1G/1G4S-TPS/1G4S-TPS_ligand.pdbqt | data/1G/1G4S-TPS/1G4S-TPS_target.pdbqt | data/1G/1G4S-TPS/1G4S-TPS_decoys.pdbqt | data/1G/1G4S-TPS/1G4S-TPS_decoy_scores.csv |
1GR2-KAI | data/1G/1GR2-KAI/1GR2-KAI_ligand.pdbqt | data/1G/1GR2-KAI/1GR2-KAI_target.pdbqt | data/1G/1GR2-KAI/1GR2-KAI_decoys.pdbqt | data/1G/1GR2-KAI/1GR2-KAI_decoy_scores.csv |
1G6K-NAD | data/1G/1G6K-NAD/1G6K-NAD_ligand.pdbqt | data/1G/1G6K-NAD/1G6K-NAD_target.pdbqt | data/1G/1G6K-NAD/1G6K-NAD_decoys.pdbqt | data/1G/1G6K-NAD/1G6K-NAD_decoy_scores.csv |
1GI3-BMZ | data/1G/1GI3-BMZ/1GI3-BMZ_ligand.pdbqt | data/1G/1GI3-BMZ/1GI3-BMZ_target.pdbqt | data/1G/1GI3-BMZ/1GI3-BMZ_decoys.pdbqt | data/1G/1GI3-BMZ/1GI3-BMZ_decoy_scores.csv |
1G4T-FTP | data/1G/1G4T-FTP/1G4T-FTP_ligand.pdbqt | data/1G/1G4T-FTP/1G4T-FTP_target.pdbqt | data/1G/1G4T-FTP/1G4T-FTP_decoys.pdbqt | data/1G/1G4T-FTP/1G4T-FTP_decoy_scores.csv |
1G72-PQQ | data/1G/1G72-PQQ/1G72-PQQ_ligand.pdbqt | data/1G/1G72-PQQ/1G72-PQQ_target.pdbqt | data/1G/1G72-PQQ/1G72-PQQ_decoys.pdbqt | data/1G/1G72-PQQ/1G72-PQQ_decoy_scores.csv |
1GX1-CDP | data/1G/1GX1-CDP/1GX1-CDP_ligand.pdbqt | data/1G/1GX1-CDP/1GX1-CDP_target.pdbqt | data/1G/1GX1-CDP/1GX1-CDP_decoys.pdbqt | data/1G/1GX1-CDP/1GX1-CDP_decoy_scores.csv |
1GNI-OLA | data/1G/1GNI-OLA/1GNI-OLA_ligand.pdbqt | data/1G/1GNI-OLA/1GNI-OLA_target.pdbqt | data/1G/1GNI-OLA/1GNI-OLA_decoys.pdbqt | data/1G/1GNI-OLA/1GNI-OLA_decoy_scores.csv |
1G4U-GDP | data/1G/1G4U-GDP/1G4U-GDP_ligand.pdbqt | data/1G/1G4U-GDP/1G4U-GDP_target.pdbqt | null | null |
1G98-PA5 | data/1G/1G98-PA5/1G98-PA5_ligand.pdbqt | data/1G/1G98-PA5/1G98-PA5_target.pdbqt | data/1G/1G98-PA5/1G98-PA5_decoys.pdbqt | data/1G/1G98-PA5/1G98-PA5_decoy_scores.csv |
1GIM-GDP | data/1G/1GIM-GDP/1GIM-GDP_ligand.pdbqt | data/1G/1GIM-GDP/1GIM-GDP_target.pdbqt | data/1G/1GIM-GDP/1GIM-GDP_decoys.pdbqt | data/1G/1GIM-GDP/1GIM-GDP_decoy_scores.csv |
1GFZ-IMP | data/1G/1GFZ-IMP/1GFZ-IMP_ligand.pdbqt | data/1G/1GFZ-IMP/1GFZ-IMP_target.pdbqt | data/1G/1GFZ-IMP/1GFZ-IMP_decoys.pdbqt | data/1G/1GFZ-IMP/1GFZ-IMP_decoy_scores.csv |
1GEX-HSA | data/1G/1GEX-HSA/1GEX-HSA_ligand.pdbqt | data/1G/1GEX-HSA/1GEX-HSA_target.pdbqt | data/1G/1GEX-HSA/1GEX-HSA_decoys.pdbqt | data/1G/1GEX-HSA/1GEX-HSA_decoy_scores.csv |
1GI1-BMZ | data/1G/1GI1-BMZ/1GI1-BMZ_ligand.pdbqt | data/1G/1GI1-BMZ/1GI1-BMZ_target.pdbqt | data/1G/1GI1-BMZ/1GI1-BMZ_decoys.pdbqt | data/1G/1GI1-BMZ/1GI1-BMZ_decoy_scores.csv |
1GFY-COL | data/1G/1GFY-COL/1GFY-COL_ligand.pdbqt | data/1G/1GFY-COL/1GFY-COL_target.pdbqt | data/1G/1GFY-COL/1GFY-COL_decoys.pdbqt | data/1G/1GFY-COL/1GFY-COL_decoy_scores.csv |
1G97-UD1 | data/1G/1G97-UD1/1G97-UD1_ligand.pdbqt | data/1G/1G97-UD1/1G97-UD1_target.pdbqt | data/1G/1G97-UD1/1G97-UD1_decoys.pdbqt | data/1G/1G97-UD1/1G97-UD1_decoy_scores.csv |
1GKY-5GP | data/1G/1GKY-5GP/1GKY-5GP_ligand.pdbqt | data/1G/1GKY-5GP/1GKY-5GP_target.pdbqt | data/1G/1GKY-5GP/1GKY-5GP_decoys.pdbqt | data/1G/1GKY-5GP/1GKY-5GP_decoy_scores.csv |
1GIJ-2PU | data/1G/1GIJ-2PU/1GIJ-2PU_ligand.pdbqt | data/1G/1GIJ-2PU/1GIJ-2PU_target.pdbqt | data/1G/1GIJ-2PU/1GIJ-2PU_decoys.pdbqt | data/1G/1GIJ-2PU/1GIJ-2PU_decoy_scores.csv |
1G1A-NAD | data/1G/1G1A-NAD/1G1A-NAD_ligand.pdbqt | data/1G/1G1A-NAD/1G1A-NAD_target.pdbqt | data/1G/1G1A-NAD/1G1A-NAD_decoys.pdbqt | data/1G/1G1A-NAD/1G1A-NAD_decoy_scores.csv |
1GRO-ICT | data/1G/1GRO-ICT/1GRO-ICT_ligand.pdbqt | data/1G/1GRO-ICT/1GRO-ICT_target.pdbqt | data/1G/1GRO-ICT/1GRO-ICT_decoys.pdbqt | data/1G/1GRO-ICT/1GRO-ICT_decoy_scores.csv |
1GUP-GDU | data/1G/1GUP-GDU/1GUP-GDU_ligand.pdbqt | data/1G/1GUP-GDU/1GUP-GDU_target.pdbqt | data/1G/1GUP-GDU/1GUP-GDU_decoys.pdbqt | data/1G/1GUP-GDU/1GUP-GDU_decoy_scores.csv |
1GHZ-120 | data/1G/1GHZ-120/1GHZ-120_ligand.pdbqt | data/1G/1GHZ-120/1GHZ-120_target.pdbqt | data/1G/1GHZ-120/1GHZ-120_decoys.pdbqt | data/1G/1GHZ-120/1GHZ-120_decoy_scores.csv |
1G37-110 | data/1G/1G37-110/1G37-110_ligand.pdbqt | data/1G/1G37-110/1G37-110_target.pdbqt | data/1G/1G37-110/1G37-110_decoys.pdbqt | data/1G/1G37-110/1G37-110_decoy_scores.csv |
1G0N-PHH | data/1G/1G0N-PHH/1G0N-PHH_ligand.pdbqt | data/1G/1G0N-PHH/1G0N-PHH_target.pdbqt | data/1G/1G0N-PHH/1G0N-PHH_decoys.pdbqt | data/1G/1G0N-PHH/1G0N-PHH_decoy_scores.csv |
1GUZ-NAD | data/1G/1GUZ-NAD/1GUZ-NAD_ligand.pdbqt | data/1G/1GUZ-NAD/1GUZ-NAD_target.pdbqt | data/1G/1GUZ-NAD/1GUZ-NAD_decoys.pdbqt | data/1G/1GUZ-NAD/1GUZ-NAD_decoy_scores.csv |
1GS4-ZK5 | data/1G/1GS4-ZK5/1GS4-ZK5_ligand.pdbqt | data/1G/1GS4-ZK5/1GS4-ZK5_target.pdbqt | data/1G/1GS4-ZK5/1GS4-ZK5_decoys.pdbqt | data/1G/1GS4-ZK5/1GS4-ZK5_decoy_scores.csv |
1GT4-UNA | data/1G/1GT4-UNA/1GT4-UNA_ligand.pdbqt | data/1G/1GT4-UNA/1GT4-UNA_target.pdbqt | data/1G/1GT4-UNA/1GT4-UNA_decoys.pdbqt | data/1G/1GT4-UNA/1GT4-UNA_decoy_scores.csv |
1GPN-HUB | data/1G/1GPN-HUB/1GPN-HUB_ligand.pdbqt | data/1G/1GPN-HUB/1GPN-HUB_target.pdbqt | data/1G/1GPN-HUB/1GPN-HUB_decoys.pdbqt | data/1G/1GPN-HUB/1GPN-HUB_decoy_scores.csv |
1G52-F2B | data/1G/1G52-F2B/1G52-F2B_ligand.pdbqt | data/1G/1G52-F2B/1G52-F2B_target.pdbqt | data/1G/1G52-F2B/1G52-F2B_decoys.pdbqt | data/1G/1G52-F2B/1G52-F2B_decoy_scores.csv |
1GG6-APF | data/1G/1GG6-APF/1GG6-APF_ligand.pdbqt | data/1G/1GG6-APF/1GG6-APF_target.pdbqt | data/1G/1GG6-APF/1GG6-APF_decoys.pdbqt | data/1G/1GG6-APF/1GG6-APF_decoy_scores.csv |
1GKD-BUM | data/1G/1GKD-BUM/1GKD-BUM_ligand.pdbqt | data/1G/1GKD-BUM/1GKD-BUM_target.pdbqt | data/1G/1GKD-BUM/1GKD-BUM_decoys.pdbqt | data/1G/1GKD-BUM/1GKD-BUM_decoy_scores.csv |
1G0O-PYQ | data/1G/1G0O-PYQ/1G0O-PYQ_ligand.pdbqt | data/1G/1G0O-PYQ/1G0O-PYQ_target.pdbqt | data/1G/1G0O-PYQ/1G0O-PYQ_decoys.pdbqt | data/1G/1G0O-PYQ/1G0O-PYQ_decoy_scores.csv |
1GNQ-CAG | data/1G/1GNQ-CAG/1GNQ-CAG_ligand.pdbqt | data/1G/1GNQ-CAG/1GNQ-CAG_target.pdbqt | data/1G/1GNQ-CAG/1GNQ-CAG_decoys.pdbqt | data/1G/1GNQ-CAG/1GNQ-CAG_decoy_scores.csv |
1GWJ-FMN | data/1G/1GWJ-FMN/1GWJ-FMN_ligand.pdbqt | data/1G/1GWJ-FMN/1GWJ-FMN_target.pdbqt | data/1G/1GWJ-FMN/1GWJ-FMN_decoys.pdbqt | data/1G/1GWJ-FMN/1GWJ-FMN_decoy_scores.csv |
1GM7-PNN | data/1G/1GM7-PNN/1GM7-PNN_ligand.pdbqt | data/1G/1GM7-PNN/1GM7-PNN_target.pdbqt | data/1G/1GM7-PNN/1GM7-PNN_decoys.pdbqt | data/1G/1GM7-PNN/1GM7-PNN_decoy_scores.csv |
1G9V-RQ3 | data/1G/1G9V-RQ3/1G9V-RQ3_ligand.pdbqt | data/1G/1G9V-RQ3/1G9V-RQ3_target.pdbqt | data/1G/1G9V-RQ3/1G9V-RQ3_decoys.pdbqt | data/1G/1G9V-RQ3/1G9V-RQ3_decoy_scores.csv |
1GO6-BGC | data/1G/1GO6-BGC/1GO6-BGC_ligand.pdbqt | data/1G/1GO6-BGC/1GO6-BGC_target.pdbqt | data/1G/1GO6-BGC/1GO6-BGC_decoys.pdbqt | data/1G/1GO6-BGC/1GO6-BGC_decoy_scores.csv |
1GA0-DVR | data/1G/1GA0-DVR/1GA0-DVR_ligand.pdbqt | data/1G/1GA0-DVR/1GA0-DVR_target.pdbqt | data/1G/1GA0-DVR/1GA0-DVR_decoys.pdbqt | data/1G/1GA0-DVR/1GA0-DVR_decoy_scores.csv |
1G93-GAL | data/1G/1G93-GAL/1G93-GAL_ligand.pdbqt | data/1G/1G93-GAL/1G93-GAL_target.pdbqt | data/1G/1G93-GAL/1G93-GAL_decoys.pdbqt | data/1G/1G93-GAL/1G93-GAL_decoy_scores.csv |
1GZF-NIR | data/1G/1GZF-NIR/1GZF-NIR_ligand.pdbqt | data/1G/1GZF-NIR/1GZF-NIR_target.pdbqt | data/1G/1GZF-NIR/1GZF-NIR_decoys.pdbqt | data/1G/1GZF-NIR/1GZF-NIR_decoy_scores.csv |
1G3C-109 | data/1G/1G3C-109/1G3C-109_ligand.pdbqt | data/1G/1G3C-109/1G3C-109_target.pdbqt | data/1G/1G3C-109/1G3C-109_decoys.pdbqt | data/1G/1G3C-109/1G3C-109_decoy_scores.csv |
1G79-FMN | data/1G/1G79-FMN/1G79-FMN_ligand.pdbqt | data/1G/1G79-FMN/1G79-FMN_target.pdbqt | data/1G/1G79-FMN/1G79-FMN_decoys.pdbqt | data/1G/1G79-FMN/1G79-FMN_decoy_scores.csv |
1G9R-UPF | data/1G/1G9R-UPF/1G9R-UPF_ligand.pdbqt | data/1G/1G9R-UPF/1G9R-UPF_target.pdbqt | data/1G/1G9R-UPF/1G9R-UPF_decoys.pdbqt | data/1G/1G9R-UPF/1G9R-UPF_decoy_scores.csv |
1GPJ-GLU | data/1G/1GPJ-GLU/1GPJ-GLU_ligand.pdbqt | data/1G/1GPJ-GLU/1GPJ-GLU_target.pdbqt | data/1G/1GPJ-GLU/1GPJ-GLU_decoys.pdbqt | data/1G/1GPJ-GLU/1GPJ-GLU_decoy_scores.csv |
1GI7-120 | data/1G/1GI7-120/1GI7-120_ligand.pdbqt | data/1G/1GI7-120/1GI7-120_target.pdbqt | data/1G/1GI7-120/1GI7-120_decoys.pdbqt | data/1G/1GI7-120/1GI7-120_decoy_scores.csv |
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