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 ⌀ |
|---|---|---|---|---|
2J8Y-PNM | data/2J/2J8Y-PNM/2J8Y-PNM_ligand.pdbqt | data/2J/2J8Y-PNM/2J8Y-PNM_target.pdbqt | data/2J/2J8Y-PNM/2J8Y-PNM_decoys.pdbqt | data/2J/2J8Y-PNM/2J8Y-PNM_decoy_scores.csv |
2JAW-BVP | data/2J/2JAW-BVP/2JAW-BVP_ligand.pdbqt | data/2J/2JAW-BVP/2JAW-BVP_target.pdbqt | data/2J/2JAW-BVP/2JAW-BVP_decoys.pdbqt | data/2J/2JAW-BVP/2JAW-BVP_decoy_scores.csv |
2JKO-BIJ | data/2J/2JKO-BIJ/2JKO-BIJ_ligand.pdbqt | data/2J/2JKO-BIJ/2JKO-BIJ_target.pdbqt | data/2J/2JKO-BIJ/2JKO-BIJ_decoys.pdbqt | data/2J/2JKO-BIJ/2JKO-BIJ_decoy_scores.csv |
2JG1-TA6 | data/2J/2JG1-TA6/2JG1-TA6_ligand.pdbqt | data/2J/2JG1-TA6/2JG1-TA6_target.pdbqt | data/2J/2JG1-TA6/2JG1-TA6_decoys.pdbqt | data/2J/2JG1-TA6/2JG1-TA6_decoy_scores.csv |
2JFN-GLU | data/2J/2JFN-GLU/2JFN-GLU_ligand.pdbqt | data/2J/2JFN-GLU/2JFN-GLU_target.pdbqt | data/2J/2JFN-GLU/2JFN-GLU_decoys.pdbqt | data/2J/2JFN-GLU/2JFN-GLU_decoy_scores.csv |
2JAM-J60 | data/2J/2JAM-J60/2JAM-J60_ligand.pdbqt | data/2J/2JAM-J60/2JAM-J60_target.pdbqt | data/2J/2JAM-J60/2JAM-J60_decoys.pdbqt | data/2J/2JAM-J60/2JAM-J60_decoy_scores.csv |
2J9Y-FOO | data/2J/2J9Y-FOO/2J9Y-FOO_ligand.pdbqt | data/2J/2J9Y-FOO/2J9Y-FOO_target.pdbqt | data/2J/2J9Y-FOO/2J9Y-FOO_decoys.pdbqt | data/2J/2J9Y-FOO/2J9Y-FOO_decoy_scores.csv |
2JFZ-003 | data/2J/2JFZ-003/2JFZ-003_ligand.pdbqt | data/2J/2JFZ-003/2JFZ-003_target.pdbqt | data/2J/2JFZ-003/2JFZ-003_decoys.pdbqt | data/2J/2JFZ-003/2JFZ-003_decoy_scores.csv |
2J3T-PLM | data/2J/2J3T-PLM/2J3T-PLM_ligand.pdbqt | data/2J/2J3T-PLM/2J3T-PLM_target.pdbqt | data/2J/2J3T-PLM/2J3T-PLM_decoys.pdbqt | data/2J/2J3T-PLM/2J3T-PLM_decoy_scores.csv |
2J51-DKI | data/2J/2J51-DKI/2J51-DKI_ligand.pdbqt | data/2J/2J51-DKI/2J51-DKI_target.pdbqt | data/2J/2J51-DKI/2J51-DKI_decoys.pdbqt | data/2J/2J51-DKI/2J51-DKI_decoy_scores.csv |
2JED-LG8 | data/2J/2JED-LG8/2JED-LG8_ligand.pdbqt | data/2J/2JED-LG8/2JED-LG8_target.pdbqt | data/2J/2JED-LG8/2JED-LG8_decoys.pdbqt | data/2J/2JED-LG8/2JED-LG8_decoy_scores.csv |
2JB4-A14 | data/2J/2JB4-A14/2JB4-A14_ligand.pdbqt | data/2J/2JB4-A14/2JB4-A14_target.pdbqt | data/2J/2JB4-A14/2JB4-A14_decoys.pdbqt | data/2J/2JB4-A14/2JB4-A14_decoy_scores.csv |
2JAL-YLL | data/2J/2JAL-YLL/2JAL-YLL_ligand.pdbqt | data/2J/2JAL-YLL/2JAL-YLL_target.pdbqt | data/2J/2JAL-YLL/2JAL-YLL_decoys.pdbqt | data/2J/2JAL-YLL/2JAL-YLL_decoy_scores.csv |
2JE8-B3P | data/2J/2JE8-B3P/2JE8-B3P_ligand.pdbqt | data/2J/2JE8-B3P/2JE8-B3P_target.pdbqt | data/2J/2JE8-B3P/2JE8-B3P_decoys.pdbqt | data/2J/2JE8-B3P/2JE8-B3P_decoy_scores.csv |
2J9L-ATP | data/2J/2J9L-ATP/2J9L-ATP_ligand.pdbqt | data/2J/2J9L-ATP/2J9L-ATP_target.pdbqt | data/2J/2J9L-ATP/2J9L-ATP_decoys.pdbqt | data/2J/2J9L-ATP/2J9L-ATP_decoy_scores.csv |
2JDS-L20 | data/2J/2JDS-L20/2JDS-L20_ligand.pdbqt | data/2J/2JDS-L20/2JDS-L20_target.pdbqt | data/2J/2JDS-L20/2JDS-L20_decoys.pdbqt | data/2J/2JDS-L20/2JDS-L20_decoy_scores.csv |
2J60-ABE | data/2J/2J60-ABE/2J60-ABE_ligand.pdbqt | data/2J/2J60-ABE/2J60-ABE_target.pdbqt | data/2J/2J60-ABE/2J60-ABE_decoys.pdbqt | data/2J/2J60-ABE/2J60-ABE_decoy_scores.csv |
2J8C-HTO | data/2J/2J8C-HTO/2J8C-HTO_ligand.pdbqt | data/2J/2J8C-HTO/2J8C-HTO_target.pdbqt | data/2J/2J8C-HTO/2J8C-HTO_decoys.pdbqt | data/2J/2J8C-HTO/2J8C-HTO_decoy_scores.csv |
2J7D-GI1 | data/2J/2J7D-GI1/2J7D-GI1_ligand.pdbqt | data/2J/2J7D-GI1/2J7D-GI1_target.pdbqt | data/2J/2J7D-GI1/2J7D-GI1_decoys.pdbqt | data/2J/2J7D-GI1/2J7D-GI1_decoy_scores.csv |
2JK5-F09 | data/2J/2JK5-F09/2JK5-F09_ligand.pdbqt | data/2J/2JK5-F09/2JK5-F09_target.pdbqt | data/2J/2JK5-F09/2JK5-F09_decoys.pdbqt | data/2J/2JK5-F09/2JK5-F09_decoy_scores.csv |
2J09-FMN | data/2J/2J09-FMN/2J09-FMN_ligand.pdbqt | data/2J/2J09-FMN/2J09-FMN_target.pdbqt | data/2J/2J09-FMN/2J09-FMN_decoys.pdbqt | data/2J/2J09-FMN/2J09-FMN_decoy_scores.csv |
2JDZ-XMM | data/2J/2JDZ-XMM/2JDZ-XMM_ligand.pdbqt | data/2J/2JDZ-XMM/2JDZ-XMM_target.pdbqt | data/2J/2JDZ-XMM/2JDZ-XMM_decoys.pdbqt | data/2J/2JDZ-XMM/2JDZ-XMM_decoy_scores.csv |
2J9A-AHY | data/2J/2J9A-AHY/2J9A-AHY_ligand.pdbqt | data/2J/2J9A-AHY/2J9A-AHY_target.pdbqt | data/2J/2J9A-AHY/2J9A-AHY_decoys.pdbqt | data/2J/2J9A-AHY/2J9A-AHY_decoy_scores.csv |
2JAR-UMP | data/2J/2JAR-UMP/2JAR-UMP_ligand.pdbqt | data/2J/2JAR-UMP/2JAR-UMP_target.pdbqt | data/2J/2JAR-UMP/2JAR-UMP_decoys.pdbqt | data/2J/2JAR-UMP/2JAR-UMP_decoy_scores.csv |
2JDD-3PG | data/2J/2JDD-3PG/2JDD-3PG_ligand.pdbqt | data/2J/2JDD-3PG/2JDD-3PG_target.pdbqt | data/2J/2JDD-3PG/2JDD-3PG_decoys.pdbqt | data/2J/2JDD-3PG/2JDD-3PG_decoy_scores.csv |
2JJ2-QUE | data/2J/2JJ2-QUE/2JJ2-QUE_ligand.pdbqt | data/2J/2JJ2-QUE/2JJ2-QUE_target.pdbqt | data/2J/2JJ2-QUE/2JJ2-QUE_decoys.pdbqt | data/2J/2JJ2-QUE/2JJ2-QUE_decoy_scores.csv |
2JCV-FOM | data/2J/2JCV-FOM/2JCV-FOM_ligand.pdbqt | data/2J/2JCV-FOM/2JCV-FOM_target.pdbqt | data/2J/2JCV-FOM/2JCV-FOM_decoys.pdbqt | data/2J/2JCV-FOM/2JCV-FOM_decoy_scores.csv |
2JDT-I5S | data/2J/2JDT-I5S/2JDT-I5S_ligand.pdbqt | data/2J/2JDT-I5S/2JDT-I5S_target.pdbqt | data/2J/2JDT-I5S/2JDT-I5S_decoys.pdbqt | data/2J/2JDT-I5S/2JDT-I5S_decoy_scores.csv |
2JGS-BTN | data/2J/2JGS-BTN/2JGS-BTN_ligand.pdbqt | data/2J/2JGS-BTN/2JGS-BTN_target.pdbqt | data/2J/2JGS-BTN/2JGS-BTN_decoys.pdbqt | data/2J/2JGS-BTN/2JGS-BTN_decoy_scores.csv |
2J8T-FLC | data/2J/2J8T-FLC/2J8T-FLC_ligand.pdbqt | data/2J/2J8T-FLC/2J8T-FLC_target.pdbqt | data/2J/2J8T-FLC/2J8T-FLC_decoys.pdbqt | data/2J/2J8T-FLC/2J8T-FLC_decoy_scores.csv |
2J40-NAD | data/2J/2J40-NAD/2J40-NAD_ligand.pdbqt | data/2J/2J40-NAD/2J40-NAD_target.pdbqt | data/2J/2J40-NAD/2J40-NAD_decoys.pdbqt | data/2J/2J40-NAD/2J40-NAD_decoy_scores.csv |
2JFG-ADP | data/2J/2JFG-ADP/2JFG-ADP_ligand.pdbqt | data/2J/2JFG-ADP/2JFG-ADP_target.pdbqt | data/2J/2JFG-ADP/2JFG-ADP_decoys.pdbqt | data/2J/2JFG-ADP/2JFG-ADP_decoy_scores.csv |
2JAP-J01 | data/2J/2JAP-J01/2JAP-J01_ligand.pdbqt | data/2J/2JAP-J01/2JAP-J01_target.pdbqt | data/2J/2JAP-J01/2JAP-J01_decoys.pdbqt | data/2J/2JAP-J01/2JAP-J01_decoy_scores.csv |
2J6H-ONL | data/2J/2J6H-ONL/2J6H-ONL_ligand.pdbqt | data/2J/2J6H-ONL/2J6H-ONL_target.pdbqt | data/2J/2J6H-ONL/2J6H-ONL_decoys.pdbqt | data/2J/2J6H-ONL/2J6H-ONL_decoy_scores.csv |
2JE9-XMM | data/2J/2JE9-XMM/2JE9-XMM_ligand.pdbqt | data/2J/2JE9-XMM/2JE9-XMM_target.pdbqt | data/2J/2JE9-XMM/2JE9-XMM_decoys.pdbqt | data/2J/2JE9-XMM/2JE9-XMM_decoy_scores.csv |
2J9G-ADP | data/2J/2J9G-ADP/2J9G-ADP_ligand.pdbqt | data/2J/2J9G-ADP/2J9G-ADP_target.pdbqt | data/2J/2J9G-ADP/2J9G-ADP_decoys.pdbqt | data/2J/2J9G-ADP/2J9G-ADP_decoy_scores.csv |
2JKN-CL8 | data/2J/2JKN-CL8/2JKN-CL8_ligand.pdbqt | data/2J/2JKN-CL8/2JKN-CL8_target.pdbqt | data/2J/2JKN-CL8/2JKN-CL8_decoys.pdbqt | data/2J/2JKN-CL8/2JKN-CL8_decoy_scores.csv |
2JAG-PLM | data/2J/2JAG-PLM/2JAG-PLM_ligand.pdbqt | data/2J/2JAG-PLM/2JAG-PLM_target.pdbqt | data/2J/2JAG-PLM/2JAG-PLM_decoys.pdbqt | data/2J/2JAG-PLM/2JAG-PLM_decoy_scores.csv |
2JCH-PL7 | data/2J/2JCH-PL7/2JCH-PL7_ligand.pdbqt | data/2J/2JCH-PL7/2JCH-PL7_target.pdbqt | data/2J/2JCH-PL7/2JCH-PL7_decoys.pdbqt | data/2J/2JCH-PL7/2JCH-PL7_decoy_scores.csv |
2JKJ-CLM | data/2J/2JKJ-CLM/2JKJ-CLM_ligand.pdbqt | data/2J/2JKJ-CLM/2JKJ-CLM_target.pdbqt | data/2J/2JKJ-CLM/2JKJ-CLM_decoys.pdbqt | data/2J/2JKJ-CLM/2JKJ-CLM_decoy_scores.csv |
2JC0-699 | data/2J/2JC0-699/2JC0-699_ligand.pdbqt | data/2J/2JC0-699/2JC0-699_target.pdbqt | data/2J/2JC0-699/2JC0-699_decoys.pdbqt | data/2J/2JC0-699/2JC0-699_decoy_scores.csv |
2JFO-DGL | data/2J/2JFO-DGL/2JFO-DGL_ligand.pdbqt | data/2J/2JFO-DGL/2JFO-DGL_target.pdbqt | data/2J/2JFO-DGL/2JFO-DGL_decoys.pdbqt | data/2J/2JFO-DGL/2JFO-DGL_decoy_scores.csv |
2J80-FLC | data/2J/2J80-FLC/2J80-FLC_ligand.pdbqt | data/2J/2J80-FLC/2J80-FLC_target.pdbqt | data/2J/2J80-FLC/2J80-FLC_decoys.pdbqt | data/2J/2J80-FLC/2J80-FLC_decoy_scores.csv |
2JH0-701 | data/2J/2JH0-701/2JH0-701_ligand.pdbqt | data/2J/2JH0-701/2JH0-701_target.pdbqt | data/2J/2JH0-701/2JH0-701_decoys.pdbqt | data/2J/2JH0-701/2JH0-701_decoy_scores.csv |
2J9G-ANP | data/2J/2J9G-ANP/2J9G-ANP_ligand.pdbqt | data/2J/2J9G-ANP/2J9G-ANP_target.pdbqt | data/2J/2J9G-ANP/2J9G-ANP_decoys.pdbqt | data/2J/2J9G-ANP/2J9G-ANP_decoy_scores.csv |
2JFL-DKI | data/2J/2JFL-DKI/2JFL-DKI_ligand.pdbqt | data/2J/2JFL-DKI/2JFL-DKI_target.pdbqt | data/2J/2JFL-DKI/2JFL-DKI_decoys.pdbqt | data/2J/2JFL-DKI/2JFL-DKI_decoy_scores.csv |
2JKM-BII | data/2J/2JKM-BII/2JKM-BII_ligand.pdbqt | data/2J/2JKM-BII/2JKM-BII_target.pdbqt | data/2J/2JKM-BII/2JKM-BII_decoys.pdbqt | data/2J/2JKM-BII/2JKM-BII_decoy_scores.csv |
2JF4-VDM | data/2J/2JF4-VDM/2JF4-VDM_ligand.pdbqt | data/2J/2JF4-VDM/2JF4-VDM_target.pdbqt | data/2J/2JF4-VDM/2JF4-VDM_decoys.pdbqt | data/2J/2JF4-VDM/2JF4-VDM_decoy_scores.csv |
2JJ3-JJ3 | data/2J/2JJ3-JJ3/2JJ3-JJ3_ligand.pdbqt | data/2J/2JJ3-JJ3/2JJ3-JJ3_target.pdbqt | data/2J/2JJ3-JJ3/2JJ3-JJ3_decoys.pdbqt | data/2J/2JJ3-JJ3/2JJ3-JJ3_decoy_scores.csv |
2JKB-SKD | data/2J/2JKB-SKD/2JKB-SKD_ligand.pdbqt | data/2J/2JKB-SKD/2JKB-SKD_target.pdbqt | data/2J/2JKB-SKD/2JKB-SKD_decoys.pdbqt | data/2J/2JKB-SKD/2JKB-SKD_decoy_scores.csv |
2J9M-PY8 | data/2J/2J9M-PY8/2J9M-PY8_ligand.pdbqt | data/2J/2J9M-PY8/2J9M-PY8_target.pdbqt | data/2J/2J9M-PY8/2J9M-PY8_decoys.pdbqt | data/2J/2J9M-PY8/2J9M-PY8_decoy_scores.csv |
2J7B-NTZ | data/2J/2J7B-NTZ/2J7B-NTZ_ligand.pdbqt | data/2J/2J7B-NTZ/2J7B-NTZ_target.pdbqt | data/2J/2J7B-NTZ/2J7B-NTZ_decoys.pdbqt | data/2J/2J7B-NTZ/2J7B-NTZ_decoy_scores.csv |
2JG1-ANP | data/2J/2JG1-ANP/2JG1-ANP_ligand.pdbqt | data/2J/2JG1-ANP/2JG1-ANP_target.pdbqt | data/2J/2JG1-ANP/2JG1-ANP_decoys.pdbqt | data/2J/2JG1-ANP/2JG1-ANP_decoy_scores.csv |
2JFX-DGL | data/2J/2JFX-DGL/2JFX-DGL_ligand.pdbqt | data/2J/2JFX-DGL/2JFX-DGL_target.pdbqt | data/2J/2JFX-DGL/2JFX-DGL_decoys.pdbqt | data/2J/2JFX-DGL/2JFX-DGL_decoy_scores.csv |
2J7P-GNP | data/2J/2J7P-GNP/2J7P-GNP_ligand.pdbqt | data/2J/2J7P-GNP/2J7P-GNP_target.pdbqt | data/2J/2J7P-GNP/2J7P-GNP_decoys.pdbqt | data/2J/2J7P-GNP/2J7P-GNP_decoy_scores.csv |
2JBL-LDA | data/2J/2JBL-LDA/2JBL-LDA_ligand.pdbqt | data/2J/2JBL-LDA/2JBL-LDA_target.pdbqt | data/2J/2JBL-LDA/2JBL-LDA_decoys.pdbqt | data/2J/2JBL-LDA/2JBL-LDA_decoy_scores.csv |
2JDM-FUC | data/2J/2JDM-FUC/2JDM-FUC_ligand.pdbqt | data/2J/2JDM-FUC/2JDM-FUC_target.pdbqt | data/2J/2JDM-FUC/2JDM-FUC_decoys.pdbqt | data/2J/2JDM-FUC/2JDM-FUC_decoy_scores.csv |
2J5V-RGP | data/2J/2J5V-RGP/2J5V-RGP_ligand.pdbqt | data/2J/2J5V-RGP/2J5V-RGP_target.pdbqt | data/2J/2J5V-RGP/2J5V-RGP_decoys.pdbqt | data/2J/2J5V-RGP/2J5V-RGP_decoy_scores.csv |
2JI8-ADP | data/2J/2JI8-ADP/2JI8-ADP_ligand.pdbqt | data/2J/2JI8-ADP/2JI8-ADP_target.pdbqt | data/2J/2JI8-ADP/2JI8-ADP_decoys.pdbqt | data/2J/2JI8-ADP/2JI8-ADP_decoy_scores.csv |
2JGB-MGT | data/2J/2JGB-MGT/2JGB-MGT_ligand.pdbqt | data/2J/2JGB-MGT/2JGB-MGT_target.pdbqt | data/2J/2JGB-MGT/2JGB-MGT_decoys.pdbqt | data/2J/2JGB-MGT/2JGB-MGT_decoy_scores.csv |
2J0V-GDP | data/2J/2J0V-GDP/2J0V-GDP_ligand.pdbqt | data/2J/2J0V-GDP/2J0V-GDP_target.pdbqt | data/2J/2J0V-GDP/2J0V-GDP_decoys.pdbqt | data/2J/2J0V-GDP/2J0V-GDP_decoy_scores.csv |
2J0B-UDP | data/2J/2J0B-UDP/2J0B-UDP_ligand.pdbqt | data/2J/2J0B-UDP/2J0B-UDP_target.pdbqt | data/2J/2J0B-UDP/2J0B-UDP_decoys.pdbqt | data/2J/2J0B-UDP/2J0B-UDP_decoy_scores.csv |
2JHF-NAD | data/2J/2JHF-NAD/2JHF-NAD_ligand.pdbqt | data/2J/2JHF-NAD/2JHF-NAD_target.pdbqt | data/2J/2JHF-NAD/2JHF-NAD_decoys.pdbqt | data/2J/2JHF-NAD/2JHF-NAD_decoy_scores.csv |
2JB2-PHE | data/2J/2JB2-PHE/2JB2-PHE_ligand.pdbqt | data/2J/2JB2-PHE/2JB2-PHE_target.pdbqt | data/2J/2JB2-PHE/2JB2-PHE_decoys.pdbqt | data/2J/2JB2-PHE/2JB2-PHE_decoy_scores.csv |
2J7X-EST | data/2J/2J7X-EST/2J7X-EST_ligand.pdbqt | data/2J/2J7X-EST/2J7X-EST_target.pdbqt | data/2J/2J7X-EST/2J7X-EST_decoys.pdbqt | data/2J/2J7X-EST/2J7X-EST_decoy_scores.csv |
2J1S-FUL | data/2J/2J1S-FUL/2J1S-FUL_ligand.pdbqt | data/2J/2J1S-FUL/2J1S-FUL_target.pdbqt | data/2J/2J1S-FUL/2J1S-FUL_decoys.pdbqt | data/2J/2J1S-FUL/2J1S-FUL_decoy_scores.csv |
2JI7-B3P | data/2J/2JI7-B3P/2JI7-B3P_ligand.pdbqt | data/2J/2JI7-B3P/2JI7-B3P_target.pdbqt | data/2J/2JI7-B3P/2JI7-B3P_decoys.pdbqt | data/2J/2JI7-B3P/2JI7-B3P_decoy_scores.csv |
2JFZ-DGL | data/2J/2JFZ-DGL/2JFZ-DGL_ligand.pdbqt | data/2J/2JFZ-DGL/2JFZ-DGL_target.pdbqt | data/2J/2JFZ-DGL/2JFZ-DGL_decoys.pdbqt | data/2J/2JFZ-DGL/2JFZ-DGL_decoy_scores.csv |
2JDV-L20 | data/2J/2JDV-L20/2JDV-L20_ligand.pdbqt | data/2J/2JDV-L20/2JDV-L20_target.pdbqt | data/2J/2JDV-L20/2JDV-L20_decoys.pdbqt | data/2J/2JDV-L20/2JDV-L20_decoy_scores.csv |
2JFV-FLC | data/2J/2JFV-FLC/2JFV-FLC_ligand.pdbqt | data/2J/2JFV-FLC/2JFV-FLC_target.pdbqt | data/2J/2JFV-FLC/2JFV-FLC_decoys.pdbqt | data/2J/2JFV-FLC/2JFV-FLC_decoy_scores.csv |
2JI9-TPW | data/2J/2JI9-TPW/2JI9-TPW_ligand.pdbqt | data/2J/2JI9-TPW/2JI9-TPW_target.pdbqt | data/2J/2JI9-TPW/2JI9-TPW_decoys.pdbqt | data/2J/2JI9-TPW/2JI9-TPW_decoy_scores.csv |
2J90-IZA | data/2J/2J90-IZA/2J90-IZA_ligand.pdbqt | data/2J/2J90-IZA/2J90-IZA_target.pdbqt | data/2J/2J90-IZA/2J90-IZA_decoys.pdbqt | data/2J/2J90-IZA/2J90-IZA_decoy_scores.csv |
2JAU-ATM | data/2J/2JAU-ATM/2JAU-ATM_ligand.pdbqt | data/2J/2JAU-ATM/2JAU-ATM_target.pdbqt | data/2J/2JAU-ATM/2JAU-ATM_decoys.pdbqt | data/2J/2JAU-ATM/2JAU-ATM_decoy_scores.csv |
2J7E-GI2 | data/2J/2J7E-GI2/2J7E-GI2_ligand.pdbqt | data/2J/2J7E-GI2/2J7E-GI2_target.pdbqt | data/2J/2J7E-GI2/2J7E-GI2_decoys.pdbqt | data/2J/2J7E-GI2/2J7E-GI2_decoy_scores.csv |
2J7Y-E3O | data/2J/2J7Y-E3O/2J7Y-E3O_ligand.pdbqt | data/2J/2J7Y-E3O/2J7Y-E3O_target.pdbqt | data/2J/2J7Y-E3O/2J7Y-E3O_decoys.pdbqt | data/2J/2J7Y-E3O/2J7Y-E3O_decoy_scores.csv |
2JI6-TPW | data/2J/2JI6-TPW/2JI6-TPW_ligand.pdbqt | data/2J/2JI6-TPW/2JI6-TPW_target.pdbqt | data/2J/2JI6-TPW/2JI6-TPW_decoys.pdbqt | data/2J/2JI6-TPW/2JI6-TPW_decoy_scores.csv |
2JFH-LK1 | data/2J/2JFH-LK1/2JFH-LK1_ligand.pdbqt | data/2J/2JFH-LK1/2JFH-LK1_target.pdbqt | data/2J/2JFH-LK1/2JFH-LK1_decoys.pdbqt | data/2J/2JFH-LK1/2JFH-LK1_decoy_scores.csv |
2JKC-TRP | data/2J/2JKC-TRP/2JKC-TRP_ligand.pdbqt | data/2J/2JKC-TRP/2JKC-TRP_target.pdbqt | data/2J/2JKC-TRP/2JKC-TRP_decoys.pdbqt | data/2J/2JKC-TRP/2JKC-TRP_decoy_scores.csv |
2JHP-SAH | data/2J/2JHP-SAH/2JHP-SAH_ligand.pdbqt | data/2J/2JHP-SAH/2JHP-SAH_target.pdbqt | data/2J/2JHP-SAH/2JHP-SAH_decoys.pdbqt | data/2J/2JHP-SAH/2JHP-SAH_decoy_scores.csv |
2JI5-UTP | data/2J/2JI5-UTP/2JI5-UTP_ligand.pdbqt | data/2J/2JI5-UTP/2JI5-UTP_target.pdbqt | data/2J/2JI5-UTP/2JI5-UTP_decoys.pdbqt | data/2J/2JI5-UTP/2JI5-UTP_decoy_scores.csv |
2JAG-RET | data/2J/2JAG-RET/2JAG-RET_ligand.pdbqt | data/2J/2JAG-RET/2JAG-RET_target.pdbqt | data/2J/2JAG-RET/2JAG-RET_decoys.pdbqt | data/2J/2JAG-RET/2JAG-RET_decoy_scores.csv |
2JCS-TTP | data/2J/2JCS-TTP/2JCS-TTP_ligand.pdbqt | data/2J/2JCS-TTP/2JCS-TTP_target.pdbqt | data/2J/2JCS-TTP/2JCS-TTP_decoys.pdbqt | data/2J/2JCS-TTP/2JCS-TTP_decoy_scores.csv |
2JIG-PD2 | data/2J/2JIG-PD2/2JIG-PD2_ligand.pdbqt | data/2J/2JIG-PD2/2JIG-PD2_target.pdbqt | data/2J/2JIG-PD2/2JIG-PD2_decoys.pdbqt | data/2J/2JIG-PD2/2JIG-PD2_decoy_scores.csv |
2JH6-894 | data/2J/2JH6-894/2JH6-894_ligand.pdbqt | data/2J/2JH6-894/2JH6-894_target.pdbqt | data/2J/2JH6-894/2JH6-894_decoys.pdbqt | data/2J/2JH6-894/2JH6-894_decoy_scores.csv |
2J4G-NB1 | data/2J/2J4G-NB1/2J4G-NB1_ligand.pdbqt | data/2J/2J4G-NB1/2J4G-NB1_target.pdbqt | data/2J/2J4G-NB1/2J4G-NB1_decoys.pdbqt | data/2J/2J4G-NB1/2J4G-NB1_decoy_scores.csv |
2J3M-ATP | data/2J/2J3M-ATP/2J3M-ATP_ligand.pdbqt | data/2J/2J3M-ATP/2J3M-ATP_target.pdbqt | data/2J/2J3M-ATP/2J3M-ATP_decoys.pdbqt | data/2J/2J3M-ATP/2J3M-ATP_decoy_scores.csv |
2JDN-FUC | data/2J/2JDN-FUC/2JDN-FUC_ligand.pdbqt | data/2J/2JDN-FUC/2JDN-FUC_target.pdbqt | data/2J/2JDN-FUC/2JDN-FUC_decoys.pdbqt | data/2J/2JDN-FUC/2JDN-FUC_decoy_scores.csv |
2JBF-PNM | data/2J/2JBF-PNM/2JBF-PNM_ligand.pdbqt | data/2J/2JBF-PNM/2JBF-PNM_target.pdbqt | data/2J/2JBF-PNM/2JBF-PNM_decoys.pdbqt | data/2J/2JBF-PNM/2JBF-PNM_decoy_scores.csv |
2J0P-12P | data/2J/2J0P-12P/2J0P-12P_ligand.pdbqt | data/2J/2J0P-12P/2J0P-12P_target.pdbqt | data/2J/2J0P-12P/2J0P-12P_decoys.pdbqt | data/2J/2J0P-12P/2J0P-12P_decoy_scores.csv |
2J6X-FMN | data/2J/2J6X-FMN/2J6X-FMN_ligand.pdbqt | data/2J/2J6X-FMN/2J6X-FMN_target.pdbqt | data/2J/2J6X-FMN/2J6X-FMN_decoys.pdbqt | data/2J/2J6X-FMN/2J6X-FMN_decoy_scores.csv |
2J34-GS6 | data/2J/2J34-GS6/2J34-GS6_ligand.pdbqt | data/2J/2J34-GS6/2J34-GS6_target.pdbqt | data/2J/2J34-GS6/2J34-GS6_decoys.pdbqt | data/2J/2J34-GS6/2J34-GS6_decoy_scores.csv |
2JHL-SLB | data/2J/2JHL-SLB/2JHL-SLB_ligand.pdbqt | data/2J/2JHL-SLB/2JHL-SLB_target.pdbqt | data/2J/2JHL-SLB/2JHL-SLB_decoys.pdbqt | data/2J/2JHL-SLB/2JHL-SLB_decoy_scores.csv |
2J2U-GSQ | data/2J/2J2U-GSQ/2J2U-GSQ_ligand.pdbqt | data/2J/2J2U-GSQ/2J2U-GSQ_target.pdbqt | data/2J/2J2U-GSQ/2J2U-GSQ_decoys.pdbqt | data/2J/2J2U-GSQ/2J2U-GSQ_decoy_scores.csv |
2J75-NOY | data/2J/2J75-NOY/2J75-NOY_ligand.pdbqt | data/2J/2J75-NOY/2J75-NOY_target.pdbqt | data/2J/2J75-NOY/2J75-NOY_decoys.pdbqt | data/2J/2J75-NOY/2J75-NOY_decoy_scores.csv |
2JJK-R15 | data/2J/2JJK-R15/2JJK-R15_ligand.pdbqt | data/2J/2JJK-R15/2JJK-R15_target.pdbqt | data/2J/2JJK-R15/2JJK-R15_decoys.pdbqt | data/2J/2JJK-R15/2JJK-R15_decoy_scores.csv |
2JI6-ADP | data/2J/2JI6-ADP/2JI6-ADP_ligand.pdbqt | data/2J/2JI6-ADP/2JI6-ADP_target.pdbqt | data/2J/2JI6-ADP/2JI6-ADP_decoys.pdbqt | data/2J/2JI6-ADP/2JI6-ADP_decoy_scores.csv |
2JI9-ADP | data/2J/2JI9-ADP/2JI9-ADP_ligand.pdbqt | data/2J/2JI9-ADP/2JI9-ADP_target.pdbqt | data/2J/2JI9-ADP/2JI9-ADP_decoys.pdbqt | data/2J/2JI9-ADP/2JI9-ADP_decoy_scores.csv |
2JKL-CLM | data/2J/2JKL-CLM/2JKL-CLM_ligand.pdbqt | data/2J/2JKL-CLM/2JKL-CLM_target.pdbqt | data/2J/2JKL-CLM/2JKL-CLM_decoys.pdbqt | data/2J/2JKL-CLM/2JKL-CLM_decoy_scores.csv |
2J41-5GP | data/2J/2J41-5GP/2J41-5GP_ligand.pdbqt | data/2J/2J41-5GP/2J41-5GP_target.pdbqt | data/2J/2J41-5GP/2J41-5GP_decoys.pdbqt | data/2J/2J41-5GP/2J41-5GP_decoy_scores.csv |
2JI7-ADP | data/2J/2JI7-ADP/2JI7-ADP_ligand.pdbqt | data/2J/2JI7-ADP/2JI7-ADP_target.pdbqt | data/2J/2JI7-ADP/2JI7-ADP_decoys.pdbqt | data/2J/2JI7-ADP/2JI7-ADP_decoy_scores.csv |
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