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 ⌀ |
|---|---|---|---|---|
5VDA-98D | data/5V/5VDA-98D/5VDA-98D_ligand.pdbqt | data/5V/5VDA-98D/5VDA-98D_target.pdbqt | data/5V/5VDA-98D/5VDA-98D_decoys.pdbqt | data/5V/5VDA-98D/5VDA-98D_decoy_scores.csv |
5VEE-981 | data/5V/5VEE-981/5VEE-981_ligand.pdbqt | data/5V/5VEE-981/5VEE-981_target.pdbqt | data/5V/5VEE-981/5VEE-981_decoys.pdbqt | data/5V/5VEE-981/5VEE-981_decoy_scores.csv |
5VN1-NAI | data/5V/5VN1-NAI/5VN1-NAI_ligand.pdbqt | data/5V/5VN1-NAI/5VN1-NAI_target.pdbqt | data/5V/5VN1-NAI/5VN1-NAI_decoys.pdbqt | data/5V/5VN1-NAI/5VN1-NAI_decoy_scores.csv |
5VBM-92V | data/5V/5VBM-92V/5VBM-92V_ligand.pdbqt | data/5V/5VBM-92V/5VBM-92V_target.pdbqt | data/5V/5VBM-92V/5VBM-92V_decoys.pdbqt | data/5V/5VBM-92V/5VBM-92V_decoy_scores.csv |
5VCP-BB2 | data/5V/5VCP-BB2/5VCP-BB2_ligand.pdbqt | data/5V/5VCP-BB2/5VCP-BB2_target.pdbqt | data/5V/5VCP-BB2/5VCP-BB2_decoys.pdbqt | data/5V/5VCP-BB2/5VCP-BB2_decoy_scores.csv |
5V8K-LMT | data/5V/5V8K-LMT/5V8K-LMT_ligand.pdbqt | data/5V/5V8K-LMT/5V8K-LMT_target.pdbqt | data/5V/5V8K-LMT/5V8K-LMT_decoys.pdbqt | data/5V/5V8K-LMT/5V8K-LMT_decoy_scores.csv |
5VGY-9AA | data/5V/5VGY-9AA/5VGY-9AA_ligand.pdbqt | data/5V/5VGY-9AA/5VGY-9AA_target.pdbqt | data/5V/5VGY-9AA/5VGY-9AA_decoys.pdbqt | data/5V/5VGY-9AA/5VGY-9AA_decoy_scores.csv |
5VUJ-JHT | data/5V/5VUJ-JHT/5VUJ-JHT_ligand.pdbqt | data/5V/5VUJ-JHT/5VUJ-JHT_target.pdbqt | data/5V/5VUJ-JHT/5VUJ-JHT_decoys.pdbqt | data/5V/5VUJ-JHT/5VUJ-JHT_decoy_scores.csv |
5VMT-NAD | data/5V/5VMT-NAD/5VMT-NAD_ligand.pdbqt | data/5V/5VMT-NAD/5VMT-NAD_target.pdbqt | data/5V/5VMT-NAD/5VMT-NAD_decoys.pdbqt | data/5V/5VMT-NAD/5VMT-NAD_decoy_scores.csv |
5VFN-HCI | data/5V/5VFN-HCI/5VFN-HCI_ligand.pdbqt | data/5V/5VFN-HCI/5VFN-HCI_target.pdbqt | data/5V/5VFN-HCI/5VFN-HCI_decoys.pdbqt | data/5V/5VFN-HCI/5VFN-HCI_decoy_scores.csv |
5VNL-CLT | data/5V/5VNL-CLT/5VNL-CLT_ligand.pdbqt | data/5V/5VNL-CLT/5VNL-CLT_target.pdbqt | data/5V/5VNL-CLT/5VNL-CLT_decoys.pdbqt | data/5V/5VNL-CLT/5VNL-CLT_decoy_scores.csv |
5VSE-9HG | data/5V/5VSE-9HG/5VSE-9HG_ligand.pdbqt | data/5V/5VSE-9HG/5VSE-9HG_target.pdbqt | data/5V/5VSE-9HG/5VSE-9HG_decoys.pdbqt | data/5V/5VSE-9HG/5VSE-9HG_decoy_scores.csv |
5VP7-GDP | data/5V/5VP7-GDP/5VP7-GDP_ligand.pdbqt | data/5V/5VP7-GDP/5VP7-GDP_target.pdbqt | data/5V/5VP7-GDP/5VP7-GDP_decoys.pdbqt | data/5V/5VP7-GDP/5VP7-GDP_decoy_scores.csv |
5V4Y-8FM | data/5V/5V4Y-8FM/5V4Y-8FM_ligand.pdbqt | data/5V/5V4Y-8FM/5V4Y-8FM_target.pdbqt | data/5V/5V4Y-8FM/5V4Y-8FM_decoys.pdbqt | data/5V/5V4Y-8FM/5V4Y-8FM_decoy_scores.csv |
5VN0-NAI | data/5V/5VN0-NAI/5VN0-NAI_ligand.pdbqt | data/5V/5VN0-NAI/5VN0-NAI_target.pdbqt | data/5V/5VN0-NAI/5VN0-NAI_decoys.pdbqt | data/5V/5VN0-NAI/5VN0-NAI_decoy_scores.csv |
5V4W-GLC | data/5V/5V4W-GLC/5V4W-GLC_ligand.pdbqt | data/5V/5V4W-GLC/5V4W-GLC_target.pdbqt | data/5V/5V4W-GLC/5V4W-GLC_decoys.pdbqt | data/5V/5V4W-GLC/5V4W-GLC_decoy_scores.csv |
5V62-FRZ | data/5V/5V62-FRZ/5V62-FRZ_ligand.pdbqt | data/5V/5V62-FRZ/5V62-FRZ_target.pdbqt | data/5V/5V62-FRZ/5V62-FRZ_decoys.pdbqt | data/5V/5V62-FRZ/5V62-FRZ_decoy_scores.csv |
5VXI-CER | data/5V/5VXI-CER/5VXI-CER_ligand.pdbqt | data/5V/5VXI-CER/5VXI-CER_target.pdbqt | data/5V/5VXI-CER/5VXI-CER_decoys.pdbqt | data/5V/5VXI-CER/5VXI-CER_decoy_scores.csv |
5VJ3-HV9 | data/5V/5VJ3-HV9/5VJ3-HV9_ligand.pdbqt | data/5V/5VJ3-HV9/5VJ3-HV9_target.pdbqt | data/5V/5VJ3-HV9/5VJ3-HV9_decoys.pdbqt | data/5V/5VJ3-HV9/5VJ3-HV9_decoy_scores.csv |
5VJE-GOS | data/5V/5VJE-GOS/5VJE-GOS_ligand.pdbqt | data/5V/5VJE-GOS/5VJE-GOS_target.pdbqt | data/5V/5VJE-GOS/5VJE-GOS_decoys.pdbqt | data/5V/5VJE-GOS/5VJE-GOS_decoy_scores.csv |
5VOO-C2F | data/5V/5VOO-C2F/5VOO-C2F_ligand.pdbqt | data/5V/5VOO-C2F/5VOO-C2F_target.pdbqt | data/5V/5VOO-C2F/5VOO-C2F_decoys.pdbqt | data/5V/5VOO-C2F/5VOO-C2F_decoy_scores.csv |
5VGO-9B1 | data/5V/5VGO-9B1/5VGO-9B1_ligand.pdbqt | data/5V/5VGO-9B1/5VGO-9B1_target.pdbqt | data/5V/5VGO-9B1/5VGO-9B1_decoys.pdbqt | data/5V/5VGO-9B1/5VGO-9B1_decoy_scores.csv |
5VBQ-R78 | data/5V/5VBQ-R78/5VBQ-R78_ligand.pdbqt | data/5V/5VBQ-R78/5VBQ-R78_target.pdbqt | data/5V/5VBQ-R78/5VBQ-R78_decoys.pdbqt | data/5V/5VBQ-R78/5VBQ-R78_decoy_scores.csv |
5V0V-8QP | data/5V/5V0V-8QP/5V0V-8QP_ligand.pdbqt | data/5V/5V0V-8QP/5V0V-8QP_target.pdbqt | data/5V/5V0V-8QP/5V0V-8QP_decoys.pdbqt | data/5V/5V0V-8QP/5V0V-8QP_decoy_scores.csv |
5V03-658 | data/5V/5V03-658/5V03-658_ligand.pdbqt | data/5V/5V03-658/5V03-658_target.pdbqt | data/5V/5V03-658/5V03-658_decoys.pdbqt | data/5V/5V03-658/5V03-658_decoy_scores.csv |
5V35-FAR | data/5V/5V35-FAR/5V35-FAR_ligand.pdbqt | data/5V/5V35-FAR/5V35-FAR_target.pdbqt | data/5V/5V35-FAR/5V35-FAR_decoys.pdbqt | data/5V/5V35-FAR/5V35-FAR_decoy_scores.csv |
5V7N-8YV | data/5V/5V7N-8YV/5V7N-8YV_ligand.pdbqt | data/5V/5V7N-8YV/5V7N-8YV_target.pdbqt | data/5V/5V7N-8YV/5V7N-8YV_decoys.pdbqt | data/5V/5V7N-8YV/5V7N-8YV_decoy_scores.csv |
5VYE-PLR | data/5V/5VYE-PLR/5VYE-PLR_ligand.pdbqt | data/5V/5VYE-PLR/5VYE-PLR_target.pdbqt | data/5V/5VYE-PLR/5VYE-PLR_decoys.pdbqt | data/5V/5VYE-PLR/5VYE-PLR_decoy_scores.csv |
5V2C-BCR | data/5V/5V2C-BCR/5V2C-BCR_ligand.pdbqt | data/5V/5V2C-BCR/5V2C-BCR_target.pdbqt | data/5V/5V2C-BCR/5V2C-BCR_decoys.pdbqt | data/5V/5V2C-BCR/5V2C-BCR_decoy_scores.csv |
5V9J-90P | data/5V/5V9J-90P/5V9J-90P_ligand.pdbqt | data/5V/5V9J-90P/5V9J-90P_target.pdbqt | data/5V/5V9J-90P/5V9J-90P_decoys.pdbqt | data/5V/5V9J-90P/5V9J-90P_decoy_scores.csv |
5VV0-9OM | data/5V/5VV0-9OM/5VV0-9OM_ligand.pdbqt | data/5V/5VV0-9OM/5VV0-9OM_target.pdbqt | data/5V/5VV0-9OM/5VV0-9OM_decoys.pdbqt | data/5V/5VV0-9OM/5VV0-9OM_decoy_scores.csv |
5V9F-GTP | data/5V/5V9F-GTP/5V9F-GTP_ligand.pdbqt | data/5V/5V9F-GTP/5V9F-GTP_target.pdbqt | data/5V/5V9F-GTP/5V9F-GTP_decoys.pdbqt | data/5V/5V9F-GTP/5V9F-GTP_decoy_scores.csv |
5VJN-ADE | data/5V/5VJN-ADE/5VJN-ADE_ligand.pdbqt | data/5V/5VJN-ADE/5VJN-ADE_target.pdbqt | data/5V/5VJN-ADE/5VJN-ADE_decoys.pdbqt | data/5V/5VJN-ADE/5VJN-ADE_decoy_scores.csv |
5V2L-ATP | data/5V/5V2L-ATP/5V2L-ATP_ligand.pdbqt | data/5V/5V2L-ATP/5V2L-ATP_target.pdbqt | data/5V/5V2L-ATP/5V2L-ATP_decoys.pdbqt | data/5V/5V2L-ATP/5V2L-ATP_decoy_scores.csv |
5VRA-OLB | data/5V/5VRA-OLB/5VRA-OLB_ligand.pdbqt | data/5V/5VRA-OLB/5VRA-OLB_target.pdbqt | data/5V/5VRA-OLB/5VRA-OLB_decoys.pdbqt | data/5V/5VRA-OLB/5VRA-OLB_decoy_scores.csv |
5VUK-9P1 | data/5V/5VUK-9P1/5VUK-9P1_ligand.pdbqt | data/5V/5VUK-9P1/5VUK-9P1_target.pdbqt | data/5V/5VUK-9P1/5VUK-9P1_decoys.pdbqt | data/5V/5VUK-9P1/5VUK-9P1_decoy_scores.csv |
5VN2-NAD | data/5V/5VN2-NAD/5VN2-NAD_ligand.pdbqt | data/5V/5VN2-NAD/5VN2-NAD_target.pdbqt | data/5V/5VN2-NAD/5VN2-NAD_decoys.pdbqt | data/5V/5VN2-NAD/5VN2-NAD_decoy_scores.csv |
5VRA-OLC | data/5V/5VRA-OLC/5VRA-OLC_ligand.pdbqt | data/5V/5VRA-OLC/5VRA-OLC_target.pdbqt | data/5V/5VRA-OLC/5VRA-OLC_decoys.pdbqt | data/5V/5VRA-OLC/5VRA-OLC_decoy_scores.csv |
5VUY-H4B | data/5V/5VUY-H4B/5VUY-H4B_ligand.pdbqt | data/5V/5VUY-H4B/5VUY-H4B_target.pdbqt | data/5V/5VUY-H4B/5VUY-H4B_decoys.pdbqt | data/5V/5VUY-H4B/5VUY-H4B_decoy_scores.csv |
5VUQ-H4B | data/5V/5VUQ-H4B/5VUQ-H4B_ligand.pdbqt | data/5V/5VUQ-H4B/5VUQ-H4B_target.pdbqt | data/5V/5VUQ-H4B/5VUQ-H4B_decoys.pdbqt | data/5V/5VUQ-H4B/5VUQ-H4B_decoy_scores.csv |
5VCU-GDP | data/5V/5VCU-GDP/5VCU-GDP_ligand.pdbqt | data/5V/5VCU-GDP/5VCU-GDP_target.pdbqt | data/5V/5VCU-GDP/5VCU-GDP_decoys.pdbqt | data/5V/5VCU-GDP/5VCU-GDP_decoy_scores.csv |
5VKH-F09 | data/5V/5VKH-F09/5VKH-F09_ligand.pdbqt | data/5V/5VKH-F09/5VKH-F09_target.pdbqt | data/5V/5VKH-F09/5VKH-F09_decoys.pdbqt | data/5V/5VKH-F09/5VKH-F09_decoy_scores.csv |
5V12-8QJ | data/5V/5V12-8QJ/5V12-8QJ_ligand.pdbqt | data/5V/5V12-8QJ/5V12-8QJ_target.pdbqt | data/5V/5V12-8QJ/5V12-8QJ_decoys.pdbqt | data/5V/5V12-8QJ/5V12-8QJ_decoy_scores.csv |
5V1S-SAM | data/5V/5V1S-SAM/5V1S-SAM_ligand.pdbqt | data/5V/5V1S-SAM/5V1S-SAM_target.pdbqt | data/5V/5V1S-SAM/5V1S-SAM_decoys.pdbqt | data/5V/5V1S-SAM/5V1S-SAM_decoy_scores.csv |
5V37-8WD | data/5V/5V37-8WD/5V37-8WD_ligand.pdbqt | data/5V/5V37-8WD/5V37-8WD_target.pdbqt | data/5V/5V37-8WD/5V37-8WD_decoys.pdbqt | data/5V/5V37-8WD/5V37-8WD_decoy_scores.csv |
5VJF-13P | data/5V/5VJF-13P/5VJF-13P_ligand.pdbqt | data/5V/5VJF-13P/5VJF-13P_target.pdbqt | data/5V/5VJF-13P/5VJF-13P_decoys.pdbqt | data/5V/5VJF-13P/5VJF-13P_decoy_scores.csv |
5VUP-9P4 | data/5V/5VUP-9P4/5VUP-9P4_ligand.pdbqt | data/5V/5VUP-9P4/5VUP-9P4_target.pdbqt | data/5V/5VUP-9P4/5VUP-9P4_decoys.pdbqt | data/5V/5VUP-9P4/5VUP-9P4_decoy_scores.csv |
5VIJ-5DX | data/5V/5VIJ-5DX/5VIJ-5DX_ligand.pdbqt | data/5V/5VIJ-5DX/5VIJ-5DX_target.pdbqt | data/5V/5VIJ-5DX/5VIJ-5DX_decoys.pdbqt | data/5V/5VIJ-5DX/5VIJ-5DX_decoy_scores.csv |
5VZ0-2BA | data/5V/5VZ0-2BA/5VZ0-2BA_ligand.pdbqt | data/5V/5VZ0-2BA/5VZ0-2BA_target.pdbqt | data/5V/5VZ0-2BA/5VZ0-2BA_decoys.pdbqt | data/5V/5VZ0-2BA/5VZ0-2BA_decoy_scores.csv |
5VIM-SAM | data/5V/5VIM-SAM/5VIM-SAM_ligand.pdbqt | data/5V/5VIM-SAM/5VIM-SAM_target.pdbqt | data/5V/5VIM-SAM/5VIM-SAM_decoys.pdbqt | data/5V/5VIM-SAM/5VIM-SAM_decoy_scores.csv |
5V2C-HTG | data/5V/5V2C-HTG/5V2C-HTG_ligand.pdbqt | data/5V/5V2C-HTG/5V2C-HTG_target.pdbqt | data/5V/5V2C-HTG/5V2C-HTG_decoys.pdbqt | data/5V/5V2C-HTG/5V2C-HTG_decoy_scores.csv |
5V2C-PE8 | data/5V/5V2C-PE8/5V2C-PE8_ligand.pdbqt | data/5V/5V2C-PE8/5V2C-PE8_target.pdbqt | data/5V/5V2C-PE8/5V2C-PE8_decoys.pdbqt | data/5V/5V2C-PE8/5V2C-PE8_decoy_scores.csv |
5V9O-91G | data/5V/5V9O-91G/5V9O-91G_ligand.pdbqt | data/5V/5V9O-91G/5V9O-91G_target.pdbqt | data/5V/5V9O-91G/5V9O-91G_decoys.pdbqt | data/5V/5V9O-91G/5V9O-91G_decoy_scores.csv |
5VB7-921 | data/5V/5VB7-921/5VB7-921_ligand.pdbqt | data/5V/5VB7-921/5VB7-921_target.pdbqt | data/5V/5VB7-921/5VB7-921_decoys.pdbqt | data/5V/5VB7-921/5VB7-921_decoy_scores.csv |
5VSB-9QA | data/5V/5VSB-9QA/5VSB-9QA_ligand.pdbqt | data/5V/5VSB-9QA/5VSB-9QA_target.pdbqt | data/5V/5VSB-9QA/5VSB-9QA_decoys.pdbqt | data/5V/5VSB-9QA/5VSB-9QA_decoy_scores.csv |
5V5Y-8X7 | data/5V/5V5Y-8X7/5V5Y-8X7_ligand.pdbqt | data/5V/5V5Y-8X7/5V5Y-8X7_target.pdbqt | data/5V/5V5Y-8X7/5V5Y-8X7_decoys.pdbqt | data/5V/5V5Y-8X7/5V5Y-8X7_decoy_scores.csv |
5VCV-1N1 | data/5V/5VCV-1N1/5VCV-1N1_ligand.pdbqt | data/5V/5VCV-1N1/5VCV-1N1_target.pdbqt | data/5V/5VCV-1N1/5VCV-1N1_decoys.pdbqt | data/5V/5VCV-1N1/5VCV-1N1_decoy_scores.csv |
5V9J-SAM | data/5V/5V9J-SAM/5V9J-SAM_ligand.pdbqt | data/5V/5V9J-SAM/5V9J-SAM_target.pdbqt | data/5V/5V9J-SAM/5V9J-SAM_decoys.pdbqt | data/5V/5V9J-SAM/5V9J-SAM_decoy_scores.csv |
5VKE-F09 | data/5V/5VKE-F09/5VKE-F09_ligand.pdbqt | data/5V/5VKE-F09/5VKE-F09_target.pdbqt | data/5V/5VKE-F09/5VKE-F09_decoys.pdbqt | data/5V/5VKE-F09/5VKE-F09_decoy_scores.csv |
5VQW-9KD | data/5V/5VQW-9KD/5VQW-9KD_ligand.pdbqt | data/5V/5VQW-9KD/5VQW-9KD_target.pdbqt | data/5V/5VQW-9KD/5VQW-9KD_decoys.pdbqt | data/5V/5VQW-9KD/5VQW-9KD_decoy_scores.csv |
5V4Q-8WY | data/5V/5V4Q-8WY/5V4Q-8WY_ligand.pdbqt | data/5V/5V4Q-8WY/5V4Q-8WY_target.pdbqt | data/5V/5V4Q-8WY/5V4Q-8WY_decoys.pdbqt | data/5V/5V4Q-8WY/5V4Q-8WY_decoy_scores.csv |
5VDN-BDF | data/5V/5VDN-BDF/5VDN-BDF_ligand.pdbqt | data/5V/5VDN-BDF/5VDN-BDF_target.pdbqt | data/5V/5VDN-BDF/5VDN-BDF_decoys.pdbqt | data/5V/5VDN-BDF/5VDN-BDF_decoy_scores.csv |
5VUC-8GR | data/5V/5VUC-8GR/5VUC-8GR_ligand.pdbqt | data/5V/5VUC-8GR/5VUC-8GR_target.pdbqt | data/5V/5VUC-8GR/5VUC-8GR_decoys.pdbqt | data/5V/5VUC-8GR/5VUC-8GR_decoy_scores.csv |
5VFD-9CM | data/5V/5VFD-9CM/5VFD-9CM_ligand.pdbqt | data/5V/5VFD-9CM/5VFD-9CM_target.pdbqt | data/5V/5VFD-9CM/5VFD-9CM_decoys.pdbqt | data/5V/5VFD-9CM/5VFD-9CM_decoy_scores.csv |
5VH0-8P0 | data/5V/5VH0-8P0/5VH0-8P0_ligand.pdbqt | data/5V/5VH0-8P0/5VH0-8P0_target.pdbqt | data/5V/5VH0-8P0/5VH0-8P0_decoys.pdbqt | data/5V/5VH0-8P0/5VH0-8P0_decoy_scores.csv |
5VGR-GDP | data/5V/5VGR-GDP/5VGR-GDP_ligand.pdbqt | data/5V/5VGR-GDP/5VGR-GDP_target.pdbqt | data/5V/5VGR-GDP/5VGR-GDP_decoys.pdbqt | data/5V/5VGR-GDP/5VGR-GDP_decoy_scores.csv |
5VLO-9EJ | data/5V/5VLO-9EJ/5VLO-9EJ_ligand.pdbqt | data/5V/5VLO-9EJ/5VLO-9EJ_target.pdbqt | data/5V/5VLO-9EJ/5VLO-9EJ_decoys.pdbqt | data/5V/5VLO-9EJ/5VLO-9EJ_decoy_scores.csv |
5VV0-H4B | data/5V/5VV0-H4B/5VV0-H4B_ligand.pdbqt | data/5V/5VV0-H4B/5VV0-H4B_target.pdbqt | data/5V/5VV0-H4B/5VV0-H4B_decoys.pdbqt | data/5V/5VV0-H4B/5VV0-H4B_decoy_scores.csv |
5V2Z-OOG | data/5V/5V2Z-OOG/5V2Z-OOG_ligand.pdbqt | data/5V/5V2Z-OOG/5V2Z-OOG_target.pdbqt | data/5V/5V2Z-OOG/5V2Z-OOG_decoys.pdbqt | data/5V/5V2Z-OOG/5V2Z-OOG_decoy_scores.csv |
5VQ6-GSP | data/5V/5VQ6-GSP/5VQ6-GSP_ligand.pdbqt | data/5V/5VQ6-GSP/5VQ6-GSP_target.pdbqt | data/5V/5VQ6-GSP/5VQ6-GSP_decoys.pdbqt | data/5V/5VQ6-GSP/5VQ6-GSP_decoy_scores.csv |
5V5E-8N4 | data/5V/5V5E-8N4/5V5E-8N4_ligand.pdbqt | data/5V/5V5E-8N4/5V5E-8N4_target.pdbqt | data/5V/5V5E-8N4/5V5E-8N4_decoys.pdbqt | data/5V/5V5E-8N4/5V5E-8N4_decoy_scores.csv |
5V7A-8Y7 | data/5V/5V7A-8Y7/5V7A-8Y7_ligand.pdbqt | data/5V/5V7A-8Y7/5V7A-8Y7_target.pdbqt | data/5V/5V7A-8Y7/5V7A-8Y7_decoys.pdbqt | data/5V/5V7A-8Y7/5V7A-8Y7_decoy_scores.csv |
5V3A-GDP | data/5V/5V3A-GDP/5V3A-GDP_ligand.pdbqt | data/5V/5V3A-GDP/5V3A-GDP_target.pdbqt | data/5V/5V3A-GDP/5V3A-GDP_decoys.pdbqt | data/5V/5V3A-GDP/5V3A-GDP_decoy_scores.csv |
5VIF-9C1 | data/5V/5VIF-9C1/5VIF-9C1_ligand.pdbqt | data/5V/5VIF-9C1/5VIF-9C1_target.pdbqt | data/5V/5VIF-9C1/5VIF-9C1_decoys.pdbqt | data/5V/5VIF-9C1/5VIF-9C1_decoy_scores.csv |
5V7P-UND | data/5V/5V7P-UND/5V7P-UND_ligand.pdbqt | data/5V/5V7P-UND/5V7P-UND_target.pdbqt | data/5V/5V7P-UND/5V7P-UND_decoys.pdbqt | data/5V/5V7P-UND/5V7P-UND_decoy_scores.csv |
5VUZ-XH8 | data/5V/5VUZ-XH8/5VUZ-XH8_ligand.pdbqt | data/5V/5VUZ-XH8/5VUZ-XH8_target.pdbqt | data/5V/5VUZ-XH8/5VUZ-XH8_decoys.pdbqt | data/5V/5VUZ-XH8/5VUZ-XH8_decoy_scores.csv |
5V2C-P6G | data/5V/5V2C-P6G/5V2C-P6G_ligand.pdbqt | data/5V/5V2C-P6G/5V2C-P6G_target.pdbqt | data/5V/5V2C-P6G/5V2C-P6G_decoys.pdbqt | data/5V/5V2C-P6G/5V2C-P6G_decoy_scores.csv |
5VUB-8GU | data/5V/5VUB-8GU/5VUB-8GU_ligand.pdbqt | data/5V/5VUB-8GU/5VUB-8GU_target.pdbqt | data/5V/5VUB-8GU/5VUB-8GU_decoys.pdbqt | data/5V/5VUB-8GU/5VUB-8GU_decoy_scores.csv |
5VIK-BLA | data/5V/5VIK-BLA/5VIK-BLA_ligand.pdbqt | data/5V/5VIK-BLA/5VIK-BLA_target.pdbqt | data/5V/5VIK-BLA/5VIK-BLA_decoys.pdbqt | data/5V/5VIK-BLA/5VIK-BLA_decoy_scores.csv |
5V1T-SAM | data/5V/5V1T-SAM/5V1T-SAM_ligand.pdbqt | data/5V/5V1T-SAM/5V1T-SAM_target.pdbqt | data/5V/5V1T-SAM/5V1T-SAM_decoys.pdbqt | data/5V/5V1T-SAM/5V1T-SAM_decoy_scores.csv |
5VKE-1EM | data/5V/5VKE-1EM/5VKE-1EM_ligand.pdbqt | data/5V/5VKE-1EM/5VKE-1EM_target.pdbqt | data/5V/5VKE-1EM/5VKE-1EM_decoys.pdbqt | data/5V/5VKE-1EM/5VKE-1EM_decoy_scores.csv |
5V9I-90P | data/5V/5V9I-90P/5V9I-90P_ligand.pdbqt | data/5V/5V9I-90P/5V9I-90P_target.pdbqt | data/5V/5V9I-90P/5V9I-90P_decoys.pdbqt | data/5V/5V9I-90P/5V9I-90P_decoy_scores.csv |
5V80-971 | data/5V/5V80-971/5V80-971_ligand.pdbqt | data/5V/5V80-971/5V80-971_target.pdbqt | data/5V/5V80-971/5V80-971_decoys.pdbqt | data/5V/5V80-971/5V80-971_decoy_scores.csv |
5VAC-SAH | data/5V/5VAC-SAH/5VAC-SAH_ligand.pdbqt | data/5V/5VAC-SAH/5VAC-SAH_target.pdbqt | data/5V/5VAC-SAH/5VAC-SAH_decoys.pdbqt | data/5V/5VAC-SAH/5VAC-SAH_decoy_scores.csv |
5VBM-GDP | data/5V/5VBM-GDP/5VBM-GDP_ligand.pdbqt | data/5V/5VBM-GDP/5VBM-GDP_target.pdbqt | data/5V/5VBM-GDP/5VBM-GDP_decoys.pdbqt | data/5V/5VBM-GDP/5VBM-GDP_decoy_scores.csv |
5VV2-9P4 | data/5V/5VV2-9P4/5VV2-9P4_ligand.pdbqt | data/5V/5VV2-9P4/5VV2-9P4_target.pdbqt | data/5V/5VV2-9P4/5VV2-9P4_decoys.pdbqt | data/5V/5VV2-9P4/5VV2-9P4_decoy_scores.csv |
5VS6-9QD | data/5V/5VS6-9QD/5VS6-9QD_ligand.pdbqt | data/5V/5VS6-9QD/5VS6-9QD_target.pdbqt | data/5V/5VS6-9QD/5VS6-9QD_decoys.pdbqt | data/5V/5VS6-9QD/5VS6-9QD_decoy_scores.csv |
5VUJ-H4B | data/5V/5VUJ-H4B/5VUJ-H4B_ligand.pdbqt | data/5V/5VUJ-H4B/5VUJ-H4B_target.pdbqt | data/5V/5VUJ-H4B/5VUJ-H4B_decoys.pdbqt | data/5V/5VUJ-H4B/5VUJ-H4B_decoy_scores.csv |
5VUT-H4B | data/5V/5VUT-H4B/5VUT-H4B_ligand.pdbqt | data/5V/5VUT-H4B/5VUT-H4B_target.pdbqt | data/5V/5VUT-H4B/5VUT-H4B_decoys.pdbqt | data/5V/5VUT-H4B/5VUT-H4B_decoy_scores.csv |
5V6V-GDP | data/5V/5V6V-GDP/5V6V-GDP_ligand.pdbqt | data/5V/5V6V-GDP/5V6V-GDP_target.pdbqt | data/5V/5V6V-GDP/5V6V-GDP_decoys.pdbqt | data/5V/5V6V-GDP/5V6V-GDP_decoy_scores.csv |
5VEF-M77 | data/5V/5VEF-M77/5VEF-M77_ligand.pdbqt | data/5V/5VEF-M77/5VEF-M77_target.pdbqt | data/5V/5VEF-M77/5VEF-M77_decoys.pdbqt | data/5V/5VEF-M77/5VEF-M77_decoy_scores.csv |
5VCZ-XZN | data/5V/5VCZ-XZN/5VCZ-XZN_ligand.pdbqt | data/5V/5VCZ-XZN/5VCZ-XZN_target.pdbqt | data/5V/5VCZ-XZN/5VCZ-XZN_decoys.pdbqt | data/5V/5VCZ-XZN/5VCZ-XZN_decoy_scores.csv |
5VPW-HCA | data/5V/5VPW-HCA/5VPW-HCA_ligand.pdbqt | data/5V/5VPW-HCA/5VPW-HCA_target.pdbqt | null | null |
5V4W-8WM | data/5V/5V4W-8WM/5V4W-8WM_ligand.pdbqt | data/5V/5V4W-8WM/5V4W-8WM_target.pdbqt | data/5V/5V4W-8WM/5V4W-8WM_decoys.pdbqt | data/5V/5V4W-8WM/5V4W-8WM_decoy_scores.csv |
5V0X-8RD | data/5V/5V0X-8RD/5V0X-8RD_ligand.pdbqt | data/5V/5V0X-8RD/5V0X-8RD_target.pdbqt | data/5V/5V0X-8RD/5V0X-8RD_decoys.pdbqt | data/5V/5V0X-8RD/5V0X-8RD_decoy_scores.csv |
5V2Z-ARG | data/5V/5V2Z-ARG/5V2Z-ARG_ligand.pdbqt | data/5V/5V2Z-ARG/5V2Z-ARG_target.pdbqt | data/5V/5V2Z-ARG/5V2Z-ARG_decoys.pdbqt | data/5V/5V2Z-ARG/5V2Z-ARG_decoy_scores.csv |
5VRJ-R07 | data/5V/5VRJ-R07/5VRJ-R07_ligand.pdbqt | data/5V/5VRJ-R07/5VRJ-R07_target.pdbqt | data/5V/5VRJ-R07/5VRJ-R07_decoys.pdbqt | data/5V/5VRJ-R07/5VRJ-R07_decoy_scores.csv |
5VEG-FMN | data/5V/5VEG-FMN/5VEG-FMN_ligand.pdbqt | data/5V/5VEG-FMN/5VEG-FMN_target.pdbqt | data/5V/5VEG-FMN/5VEG-FMN_decoys.pdbqt | data/5V/5VEG-FMN/5VEG-FMN_decoy_scores.csv |
5VHB-9CY | data/5V/5VHB-9CY/5VHB-9CY_ligand.pdbqt | data/5V/5VHB-9CY/5VHB-9CY_target.pdbqt | data/5V/5VHB-9CY/5VHB-9CY_decoys.pdbqt | data/5V/5VHB-9CY/5VHB-9CY_decoy_scores.csv |
5VUA-8GX | data/5V/5VUA-8GX/5VUA-8GX_ligand.pdbqt | data/5V/5VUA-8GX/5VUA-8GX_target.pdbqt | data/5V/5VUA-8GX/5VUA-8GX_decoys.pdbqt | data/5V/5VUA-8GX/5VUA-8GX_decoy_scores.csv |
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