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 ⌀ |
|---|---|---|---|---|
3OOD-EPL | data/3O/3OOD-EPL/3OOD-EPL_ligand.pdbqt | data/3O/3OOD-EPL/3OOD-EPL_target.pdbqt | data/3O/3OOD-EPL/3OOD-EPL_decoys.pdbqt | data/3O/3OOD-EPL/3OOD-EPL_decoy_scores.csv |
3O0O-5AD | data/3O/3O0O-5AD/3O0O-5AD_ligand.pdbqt | data/3O/3O0O-5AD/3O0O-5AD_target.pdbqt | data/3O/3O0O-5AD/3O0O-5AD_decoys.pdbqt | data/3O/3O0O-5AD/3O0O-5AD_decoy_scores.csv |
3OH2-GDU | data/3O/3OH2-GDU/3OH2-GDU_ligand.pdbqt | data/3O/3OH2-GDU/3OH2-GDU_target.pdbqt | data/3O/3OH2-GDU/3OH2-GDU_decoys.pdbqt | data/3O/3OH2-GDU/3OH2-GDU_decoy_scores.csv |
3OPH-MA4 | data/3O/3OPH-MA4/3OPH-MA4_ligand.pdbqt | data/3O/3OPH-MA4/3OPH-MA4_target.pdbqt | data/3O/3OPH-MA4/3OPH-MA4_decoys.pdbqt | data/3O/3OPH-MA4/3OPH-MA4_decoy_scores.csv |
3OTG-TYD | data/3O/3OTG-TYD/3OTG-TYD_ligand.pdbqt | data/3O/3OTG-TYD/3OTG-TYD_target.pdbqt | data/3O/3OTG-TYD/3OTG-TYD_decoys.pdbqt | data/3O/3OTG-TYD/3OTG-TYD_decoy_scores.csv |
3OE4-610 | data/3O/3OE4-610/3OE4-610_ligand.pdbqt | data/3O/3OE4-610/3OE4-610_target.pdbqt | data/3O/3OE4-610/3OE4-610_decoys.pdbqt | data/3O/3OE4-610/3OE4-610_decoy_scores.csv |
3OZF-HPA | data/3O/3OZF-HPA/3OZF-HPA_ligand.pdbqt | data/3O/3OZF-HPA/3OZF-HPA_target.pdbqt | data/3O/3OZF-HPA/3OZF-HPA_decoys.pdbqt | data/3O/3OZF-HPA/3OZF-HPA_decoy_scores.csv |
3OF4-FMN | data/3O/3OF4-FMN/3OF4-FMN_ligand.pdbqt | data/3O/3OF4-FMN/3OF4-FMN_target.pdbqt | data/3O/3OF4-FMN/3OF4-FMN_decoys.pdbqt | data/3O/3OF4-FMN/3OF4-FMN_decoy_scores.csv |
3OU6-SAM | data/3O/3OU6-SAM/3OU6-SAM_ligand.pdbqt | data/3O/3OU6-SAM/3OU6-SAM_target.pdbqt | data/3O/3OU6-SAM/3OU6-SAM_decoys.pdbqt | data/3O/3OU6-SAM/3OU6-SAM_decoy_scores.csv |
3OWB-BSM | data/3O/3OWB-BSM/3OWB-BSM_ligand.pdbqt | data/3O/3OWB-BSM/3OWB-BSM_target.pdbqt | data/3O/3OWB-BSM/3OWB-BSM_decoys.pdbqt | data/3O/3OWB-BSM/3OWB-BSM_decoy_scores.csv |
3O1G-O75 | data/3O/3O1G-O75/3O1G-O75_ligand.pdbqt | data/3O/3O1G-O75/3O1G-O75_target.pdbqt | data/3O/3O1G-O75/3O1G-O75_decoys.pdbqt | data/3O/3O1G-O75/3O1G-O75_decoy_scores.csv |
3OYS-OYS | data/3O/3OYS-OYS/3OYS-OYS_ligand.pdbqt | data/3O/3OYS-OYS/3OYS-OYS_target.pdbqt | data/3O/3OYS-OYS/3OYS-OYS_decoys.pdbqt | data/3O/3OYS-OYS/3OYS-OYS_decoy_scores.csv |
3OPP-SA2 | data/3O/3OPP-SA2/3OPP-SA2_ligand.pdbqt | data/3O/3OPP-SA2/3OPP-SA2_target.pdbqt | data/3O/3OPP-SA2/3OPP-SA2_decoys.pdbqt | data/3O/3OPP-SA2/3OPP-SA2_decoy_scores.csv |
3O08-NHE | data/3O/3O08-NHE/3O08-NHE_ligand.pdbqt | data/3O/3O08-NHE/3O08-NHE_target.pdbqt | data/3O/3O08-NHE/3O08-NHE_decoys.pdbqt | data/3O/3O08-NHE/3O08-NHE_decoy_scores.csv |
3OKF-NAD | data/3O/3OKF-NAD/3OKF-NAD_ligand.pdbqt | data/3O/3OKF-NAD/3OKF-NAD_target.pdbqt | data/3O/3OKF-NAD/3OKF-NAD_decoys.pdbqt | data/3O/3OKF-NAD/3OKF-NAD_decoy_scores.csv |
3OH4-UPG | data/3O/3OH4-UPG/3OH4-UPG_ligand.pdbqt | data/3O/3OH4-UPG/3OH4-UPG_target.pdbqt | data/3O/3OH4-UPG/3OH4-UPG_decoys.pdbqt | data/3O/3OH4-UPG/3OH4-UPG_decoy_scores.csv |
3O4W-NHE | data/3O/3O4W-NHE/3O4W-NHE_ligand.pdbqt | data/3O/3O4W-NHE/3O4W-NHE_target.pdbqt | data/3O/3O4W-NHE/3O4W-NHE_decoys.pdbqt | data/3O/3O4W-NHE/3O4W-NHE_decoy_scores.csv |
3OEW-NAD | data/3O/3OEW-NAD/3OEW-NAD_ligand.pdbqt | data/3O/3OEW-NAD/3OEW-NAD_target.pdbqt | data/3O/3OEW-NAD/3OEW-NAD_decoys.pdbqt | data/3O/3OEW-NAD/3OEW-NAD_decoy_scores.csv |
3OAY-BDF | data/3O/3OAY-BDF/3OAY-BDF_ligand.pdbqt | data/3O/3OAY-BDF/3OAY-BDF_target.pdbqt | data/3O/3OAY-BDF/3OAY-BDF_decoys.pdbqt | data/3O/3OAY-BDF/3OAY-BDF_decoy_scores.csv |
3OUZ-ADP | data/3O/3OUZ-ADP/3OUZ-ADP_ligand.pdbqt | data/3O/3OUZ-ADP/3OUZ-ADP_target.pdbqt | data/3O/3OUZ-ADP/3OUZ-ADP_decoys.pdbqt | data/3O/3OUZ-ADP/3OUZ-ADP_decoy_scores.csv |
3OAB-IPE | data/3O/3OAB-IPE/3OAB-IPE_ligand.pdbqt | data/3O/3OAB-IPE/3OAB-IPE_target.pdbqt | data/3O/3OAB-IPE/3OAB-IPE_decoys.pdbqt | data/3O/3OAB-IPE/3OAB-IPE_decoy_scores.csv |
3OJN-P6G | data/3O/3OJN-P6G/3OJN-P6G_ligand.pdbqt | data/3O/3OJN-P6G/3OJN-P6G_target.pdbqt | data/3O/3OJN-P6G/3OJN-P6G_decoys.pdbqt | data/3O/3OJN-P6G/3OJN-P6G_decoy_scores.csv |
3OOI-SAM | data/3O/3OOI-SAM/3OOI-SAM_ligand.pdbqt | data/3O/3OOI-SAM/3OOI-SAM_target.pdbqt | data/3O/3OOI-SAM/3OOI-SAM_decoys.pdbqt | data/3O/3OOI-SAM/3OOI-SAM_decoy_scores.csv |
3O22-PLM | data/3O/3O22-PLM/3O22-PLM_ligand.pdbqt | data/3O/3O22-PLM/3O22-PLM_target.pdbqt | data/3O/3O22-PLM/3O22-PLM_decoys.pdbqt | data/3O/3O22-PLM/3O22-PLM_decoy_scores.csv |
3OAB-DST | data/3O/3OAB-DST/3OAB-DST_ligand.pdbqt | data/3O/3OAB-DST/3OAB-DST_target.pdbqt | data/3O/3OAB-DST/3OAB-DST_decoys.pdbqt | data/3O/3OAB-DST/3OAB-DST_decoy_scores.csv |
3OOF-OOF | data/3O/3OOF-OOF/3OOF-OOF_ligand.pdbqt | data/3O/3OOF-OOF/3OOF-OOF_target.pdbqt | data/3O/3OOF-OOF/3OOF-OOF_decoys.pdbqt | data/3O/3OOF-OOF/3OOF-OOF_decoy_scores.csv |
3O8I-M1T | data/3O/3O8I-M1T/3O8I-M1T_ligand.pdbqt | data/3O/3O8I-M1T/3O8I-M1T_target.pdbqt | data/3O/3O8I-M1T/3O8I-M1T_decoys.pdbqt | data/3O/3O8I-M1T/3O8I-M1T_decoy_scores.csv |
3ONC-LDT | data/3O/3ONC-LDT/3ONC-LDT_ligand.pdbqt | data/3O/3ONC-LDT/3ONC-LDT_target.pdbqt | data/3O/3ONC-LDT/3ONC-LDT_decoys.pdbqt | data/3O/3ONC-LDT/3ONC-LDT_decoy_scores.csv |
3OD4-8XQ | data/3O/3OD4-8XQ/3OD4-8XQ_ligand.pdbqt | data/3O/3OD4-8XQ/3OD4-8XQ_target.pdbqt | data/3O/3OD4-8XQ/3OD4-8XQ_decoys.pdbqt | data/3O/3OD4-8XQ/3OD4-8XQ_decoy_scores.csv |
3O64-786 | data/3O/3O64-786/3O64-786_ligand.pdbqt | data/3O/3O64-786/3O64-786_target.pdbqt | data/3O/3O64-786/3O64-786_decoys.pdbqt | data/3O/3O64-786/3O64-786_decoy_scores.csv |
3OZU-X89 | data/3O/3OZU-X89/3OZU-X89_ligand.pdbqt | data/3O/3OZU-X89/3OZU-X89_target.pdbqt | data/3O/3OZU-X89/3OZU-X89_decoys.pdbqt | data/3O/3OZU-X89/3OZU-X89_decoy_scores.csv |
3OX4-NAD | data/3O/3OX4-NAD/3OX4-NAD_ligand.pdbqt | data/3O/3OX4-NAD/3OX4-NAD_target.pdbqt | data/3O/3OX4-NAD/3OX4-NAD_decoys.pdbqt | data/3O/3OX4-NAD/3OX4-NAD_decoy_scores.csv |
3O2G-NM2 | data/3O/3O2G-NM2/3O2G-NM2_ligand.pdbqt | data/3O/3O2G-NM2/3O2G-NM2_target.pdbqt | data/3O/3O2G-NM2/3O2G-NM2_decoys.pdbqt | data/3O/3O2G-NM2/3O2G-NM2_decoy_scores.csv |
3OLF-OLF | data/3O/3OLF-OLF/3OLF-OLF_ligand.pdbqt | data/3O/3OLF-OLF/3OLF-OLF_target.pdbqt | data/3O/3OLF-OLF/3OLF-OLF_decoys.pdbqt | data/3O/3OLF-OLF/3OLF-OLF_decoy_scores.csv |
3OBL-CXS | data/3O/3OBL-CXS/3OBL-CXS_ligand.pdbqt | data/3O/3OBL-CXS/3OBL-CXS_target.pdbqt | data/3O/3OBL-CXS/3OBL-CXS_decoys.pdbqt | data/3O/3OBL-CXS/3OBL-CXS_decoy_scores.csv |
3OF1-CMP | data/3O/3OF1-CMP/3OF1-CMP_ligand.pdbqt | data/3O/3OF1-CMP/3OF1-CMP_target.pdbqt | data/3O/3OF1-CMP/3OF1-CMP_decoys.pdbqt | data/3O/3OF1-CMP/3OF1-CMP_decoy_scores.csv |
3OVQ-5RP | data/3O/3OVQ-5RP/3OVQ-5RP_ligand.pdbqt | data/3O/3OVQ-5RP/3OVQ-5RP_target.pdbqt | data/3O/3OVQ-5RP/3OVQ-5RP_decoys.pdbqt | data/3O/3OVQ-5RP/3OVQ-5RP_decoy_scores.csv |
3O7W-SAM | data/3O/3O7W-SAM/3O7W-SAM_ligand.pdbqt | data/3O/3O7W-SAM/3O7W-SAM_target.pdbqt | data/3O/3O7W-SAM/3O7W-SAM_decoys.pdbqt | data/3O/3O7W-SAM/3O7W-SAM_decoy_scores.csv |
3OEZ-STI | data/3O/3OEZ-STI/3OEZ-STI_ligand.pdbqt | data/3O/3OEZ-STI/3OEZ-STI_target.pdbqt | data/3O/3OEZ-STI/3OEZ-STI_decoys.pdbqt | data/3O/3OEZ-STI/3OEZ-STI_decoy_scores.csv |
3OKE-KO2 | data/3O/3OKE-KO2/3OKE-KO2_ligand.pdbqt | data/3O/3OKE-KO2/3OKE-KO2_target.pdbqt | data/3O/3OKE-KO2/3OKE-KO2_decoys.pdbqt | data/3O/3OKE-KO2/3OKE-KO2_decoy_scores.csv |
3OUU-ANP | data/3O/3OUU-ANP/3OUU-ANP_ligand.pdbqt | data/3O/3OUU-ANP/3OUU-ANP_target.pdbqt | data/3O/3OUU-ANP/3OUU-ANP_decoys.pdbqt | data/3O/3OUU-ANP/3OUU-ANP_decoy_scores.csv |
3O2Y-OLA | data/3O/3O2Y-OLA/3O2Y-OLA_ligand.pdbqt | data/3O/3O2Y-OLA/3O2Y-OLA_target.pdbqt | data/3O/3O2Y-OLA/3O2Y-OLA_decoys.pdbqt | data/3O/3O2Y-OLA/3O2Y-OLA_decoy_scores.csv |
3OF8-I0Y | data/3O/3OF8-I0Y/3OF8-I0Y_ligand.pdbqt | data/3O/3OF8-I0Y/3OF8-I0Y_target.pdbqt | data/3O/3OF8-I0Y/3OF8-I0Y_decoys.pdbqt | data/3O/3OF8-I0Y/3OF8-I0Y_decoy_scores.csv |
3O84-HTJ | data/3O/3O84-HTJ/3O84-HTJ_ligand.pdbqt | data/3O/3O84-HTJ/3O84-HTJ_target.pdbqt | data/3O/3O84-HTJ/3O84-HTJ_decoys.pdbqt | data/3O/3O84-HTJ/3O84-HTJ_decoy_scores.csv |
3OZL-FLF | data/3O/3OZL-FLF/3OZL-FLF_ligand.pdbqt | data/3O/3OZL-FLF/3OZL-FLF_target.pdbqt | data/3O/3OZL-FLF/3OZL-FLF_decoys.pdbqt | data/3O/3OZL-FLF/3OZL-FLF_decoy_scores.csv |
3O07-G3H | data/3O/3O07-G3H/3O07-G3H_ligand.pdbqt | data/3O/3O07-G3H/3O07-G3H_target.pdbqt | data/3O/3O07-G3H/3O07-G3H_decoys.pdbqt | data/3O/3O07-G3H/3O07-G3H_decoy_scores.csv |
3O4P-ME2 | data/3O/3O4P-ME2/3O4P-ME2_ligand.pdbqt | data/3O/3O4P-ME2/3O4P-ME2_target.pdbqt | data/3O/3O4P-ME2/3O4P-ME2_decoys.pdbqt | data/3O/3O4P-ME2/3O4P-ME2_decoy_scores.csv |
3O0Q-TTP | data/3O/3O0Q-TTP/3O0Q-TTP_ligand.pdbqt | data/3O/3O0Q-TTP/3O0Q-TTP_target.pdbqt | data/3O/3O0Q-TTP/3O0Q-TTP_decoys.pdbqt | data/3O/3O0Q-TTP/3O0Q-TTP_decoy_scores.csv |
3O18-CYC | data/3O/3O18-CYC/3O18-CYC_ligand.pdbqt | data/3O/3O18-CYC/3O18-CYC_target.pdbqt | data/3O/3O18-CYC/3O18-CYC_decoys.pdbqt | data/3O/3O18-CYC/3O18-CYC_decoy_scores.csv |
3O4V-4CT | data/3O/3O4V-4CT/3O4V-4CT_ligand.pdbqt | data/3O/3O4V-4CT/3O4V-4CT_target.pdbqt | data/3O/3O4V-4CT/3O4V-4CT_decoys.pdbqt | data/3O/3O4V-4CT/3O4V-4CT_decoy_scores.csv |
3OSO-THP | data/3O/3OSO-THP/3OSO-THP_ligand.pdbqt | data/3O/3OSO-THP/3OSO-THP_target.pdbqt | data/3O/3OSO-THP/3OSO-THP_decoys.pdbqt | data/3O/3OSO-THP/3OSO-THP_decoy_scores.csv |
3OHR-ADP | data/3O/3OHR-ADP/3OHR-ADP_ligand.pdbqt | data/3O/3OHR-ADP/3OHR-ADP_target.pdbqt | data/3O/3OHR-ADP/3OHR-ADP_decoys.pdbqt | data/3O/3OHR-ADP/3OHR-ADP_decoy_scores.csv |
3OKC-GDP | data/3O/3OKC-GDP/3OKC-GDP_ligand.pdbqt | data/3O/3OKC-GDP/3OKC-GDP_target.pdbqt | data/3O/3OKC-GDP/3OKC-GDP_decoys.pdbqt | data/3O/3OKC-GDP/3OKC-GDP_decoy_scores.csv |
3OMA-DMU | data/3O/3OMA-DMU/3OMA-DMU_ligand.pdbqt | data/3O/3OMA-DMU/3OMA-DMU_target.pdbqt | data/3O/3OMA-DMU/3OMA-DMU_decoys.pdbqt | data/3O/3OMA-DMU/3OMA-DMU_decoy_scores.csv |
3O0F-AMP | data/3O/3O0F-AMP/3O0F-AMP_ligand.pdbqt | data/3O/3O0F-AMP/3O0F-AMP_target.pdbqt | data/3O/3O0F-AMP/3O0F-AMP_decoys.pdbqt | data/3O/3O0F-AMP/3O0F-AMP_decoy_scores.csv |
3OCT-1N1 | data/3O/3OCT-1N1/3OCT-1N1_ligand.pdbqt | data/3O/3OCT-1N1/3OCT-1N1_target.pdbqt | data/3O/3OCT-1N1/3OCT-1N1_decoys.pdbqt | data/3O/3OCT-1N1/3OCT-1N1_decoy_scores.csv |
3O01-DXC | data/3O/3O01-DXC/3O01-DXC_ligand.pdbqt | data/3O/3O01-DXC/3O01-DXC_target.pdbqt | data/3O/3O01-DXC/3O01-DXC_decoys.pdbqt | data/3O/3O01-DXC/3O01-DXC_decoy_scores.csv |
3ORK-AGS | data/3O/3ORK-AGS/3ORK-AGS_ligand.pdbqt | data/3O/3ORK-AGS/3ORK-AGS_target.pdbqt | data/3O/3ORK-AGS/3ORK-AGS_decoys.pdbqt | data/3O/3ORK-AGS/3ORK-AGS_decoy_scores.csv |
3OW6-MEX | data/3O/3OW6-MEX/3OW6-MEX_ligand.pdbqt | data/3O/3OW6-MEX/3OW6-MEX_target.pdbqt | data/3O/3OW6-MEX/3OW6-MEX_decoys.pdbqt | data/3O/3OW6-MEX/3OW6-MEX_decoy_scores.csv |
3OU2-SAH | data/3O/3OU2-SAH/3OU2-SAH_ligand.pdbqt | data/3O/3OU2-SAH/3OU2-SAH_target.pdbqt | data/3O/3OU2-SAH/3OU2-SAH_decoys.pdbqt | data/3O/3OU2-SAH/3OU2-SAH_decoy_scores.csv |
3OWN-3OW | data/3O/3OWN-3OW/3OWN-3OW_ligand.pdbqt | data/3O/3OWN-3OW/3OWN-3OW_target.pdbqt | data/3O/3OWN-3OW/3OWN-3OW_decoys.pdbqt | data/3O/3OWN-3OW/3OWN-3OW_decoy_scores.csv |
3OVM-MZC | data/3O/3OVM-MZC/3OVM-MZC_ligand.pdbqt | data/3O/3OVM-MZC/3OVM-MZC_target.pdbqt | data/3O/3OVM-MZC/3OVM-MZC_decoys.pdbqt | data/3O/3OVM-MZC/3OVM-MZC_decoy_scores.csv |
3O5U-MYY | data/3O/3O5U-MYY/3O5U-MYY_ligand.pdbqt | data/3O/3O5U-MYY/3O5U-MYY_target.pdbqt | data/3O/3O5U-MYY/3O5U-MYY_decoys.pdbqt | data/3O/3O5U-MYY/3O5U-MYY_decoy_scores.csv |
3OMO-WV7 | data/3O/3OMO-WV7/3OMO-WV7_ligand.pdbqt | data/3O/3OMO-WV7/3OMO-WV7_target.pdbqt | data/3O/3OMO-WV7/3OMO-WV7_decoys.pdbqt | data/3O/3OMO-WV7/3OMO-WV7_decoy_scores.csv |
3O8A-LDA | data/3O/3O8A-LDA/3O8A-LDA_ligand.pdbqt | data/3O/3O8A-LDA/3O8A-LDA_target.pdbqt | data/3O/3O8A-LDA/3O8A-LDA_decoys.pdbqt | data/3O/3O8A-LDA/3O8A-LDA_decoy_scores.csv |
3OV4-EQU | data/3O/3OV4-EQU/3OV4-EQU_ligand.pdbqt | data/3O/3OV4-EQU/3OV4-EQU_target.pdbqt | data/3O/3OV4-EQU/3OV4-EQU_decoys.pdbqt | data/3O/3OV4-EQU/3OV4-EQU_decoy_scores.csv |
3OIG-IMJ | data/3O/3OIG-IMJ/3OIG-IMJ_ligand.pdbqt | data/3O/3OIG-IMJ/3OIG-IMJ_target.pdbqt | data/3O/3OIG-IMJ/3OIG-IMJ_decoys.pdbqt | data/3O/3OIG-IMJ/3OIG-IMJ_decoy_scores.csv |
3OQJ-3CX | data/3O/3OQJ-3CX/3OQJ-3CX_ligand.pdbqt | data/3O/3OQJ-3CX/3OQJ-3CX_target.pdbqt | data/3O/3OQJ-3CX/3OQJ-3CX_decoys.pdbqt | data/3O/3OQJ-3CX/3OQJ-3CX_decoy_scores.csv |
3O6G-GLU | data/3O/3O6G-GLU/3O6G-GLU_ligand.pdbqt | data/3O/3O6G-GLU/3O6G-GLU_target.pdbqt | data/3O/3O6G-GLU/3O6G-GLU_decoys.pdbqt | data/3O/3O6G-GLU/3O6G-GLU_decoy_scores.csv |
3O75-F1X | data/3O/3O75-F1X/3O75-F1X_ligand.pdbqt | data/3O/3O75-F1X/3O75-F1X_target.pdbqt | data/3O/3O75-F1X/3O75-F1X_decoys.pdbqt | data/3O/3O75-F1X/3O75-F1X_decoy_scores.csv |
3OEM-OEM | data/3O/3OEM-OEM/3OEM-OEM_ligand.pdbqt | data/3O/3OEM-OEM/3OEM-OEM_target.pdbqt | data/3O/3OEM-OEM/3OEM-OEM_decoys.pdbqt | data/3O/3OEM-OEM/3OEM-OEM_decoy_scores.csv |
3ONI-JQ1 | data/3O/3ONI-JQ1/3ONI-JQ1_ligand.pdbqt | data/3O/3ONI-JQ1/3ONI-JQ1_target.pdbqt | data/3O/3ONI-JQ1/3ONI-JQ1_decoys.pdbqt | data/3O/3ONI-JQ1/3ONI-JQ1_decoy_scores.csv |
3OMA-HTH | data/3O/3OMA-HTH/3OMA-HTH_ligand.pdbqt | data/3O/3OMA-HTH/3OMA-HTH_target.pdbqt | data/3O/3OMA-HTH/3OMA-HTH_decoys.pdbqt | data/3O/3OMA-HTH/3OMA-HTH_decoy_scores.csv |
3ORO-AGS | data/3O/3ORO-AGS/3ORO-AGS_ligand.pdbqt | data/3O/3ORO-AGS/3ORO-AGS_target.pdbqt | data/3O/3ORO-AGS/3ORO-AGS_decoys.pdbqt | data/3O/3ORO-AGS/3ORO-AGS_decoy_scores.csv |
3O7B-SAH | data/3O/3O7B-SAH/3O7B-SAH_ligand.pdbqt | data/3O/3O7B-SAH/3O7B-SAH_target.pdbqt | data/3O/3O7B-SAH/3O7B-SAH_decoys.pdbqt | data/3O/3O7B-SAH/3O7B-SAH_decoy_scores.csv |
3O8G-O8G | data/3O/3O8G-O8G/3O8G-O8G_ligand.pdbqt | data/3O/3O8G-O8G/3O8G-O8G_target.pdbqt | data/3O/3O8G-O8G/3O8G-O8G_decoys.pdbqt | data/3O/3O8G-O8G/3O8G-O8G_decoy_scores.csv |
3ORX-1F8 | data/3O/3ORX-1F8/3ORX-1F8_ligand.pdbqt | data/3O/3ORX-1F8/3ORX-1F8_target.pdbqt | data/3O/3ORX-1F8/3ORX-1F8_decoys.pdbqt | data/3O/3ORX-1F8/3ORX-1F8_decoy_scores.csv |
3OZO-NGT | data/3O/3OZO-NGT/3OZO-NGT_ligand.pdbqt | data/3O/3OZO-NGT/3OZO-NGT_target.pdbqt | data/3O/3OZO-NGT/3OZO-NGT_decoys.pdbqt | data/3O/3OZO-NGT/3OZO-NGT_decoy_scores.csv |
3O9J-RP6 | data/3O/3O9J-RP6/3O9J-RP6_ligand.pdbqt | data/3O/3O9J-RP6/3O9J-RP6_target.pdbqt | data/3O/3O9J-RP6/3O9J-RP6_decoys.pdbqt | data/3O/3O9J-RP6/3O9J-RP6_decoy_scores.csv |
3OEL-DGL | data/3O/3OEL-DGL/3OEL-DGL_ligand.pdbqt | data/3O/3OEL-DGL/3OEL-DGL_target.pdbqt | data/3O/3OEL-DGL/3OEL-DGL_decoys.pdbqt | data/3O/3OEL-DGL/3OEL-DGL_decoy_scores.csv |
3O8D-ADP | data/3O/3O8D-ADP/3O8D-ADP_ligand.pdbqt | data/3O/3O8D-ADP/3O8D-ADP_target.pdbqt | null | null |
3OMI-TRD | data/3O/3OMI-TRD/3OMI-TRD_ligand.pdbqt | data/3O/3OMI-TRD/3OMI-TRD_target.pdbqt | data/3O/3OMI-TRD/3OMI-TRD_decoys.pdbqt | data/3O/3OMI-TRD/3OMI-TRD_decoy_scores.csv |
3OCG-OCG | data/3O/3OCG-OCG/3OCG-OCG_ligand.pdbqt | data/3O/3OCG-OCG/3OCG-OCG_target.pdbqt | data/3O/3OCG-OCG/3OCG-OCG_decoys.pdbqt | data/3O/3OCG-OCG/3OCG-OCG_decoy_scores.csv |
3OKD-KDO | data/3O/3OKD-KDO/3OKD-KDO_ligand.pdbqt | data/3O/3OKD-KDO/3OKD-KDO_target.pdbqt | data/3O/3OKD-KDO/3OKD-KDO_decoys.pdbqt | data/3O/3OKD-KDO/3OKD-KDO_decoy_scores.csv |
3OFS-AVU | data/3O/3OFS-AVU/3OFS-AVU_ligand.pdbqt | data/3O/3OFS-AVU/3OFS-AVU_target.pdbqt | data/3O/3OFS-AVU/3OFS-AVU_decoys.pdbqt | data/3O/3OFS-AVU/3OFS-AVU_decoy_scores.csv |
3OOJ-G6Q | data/3O/3OOJ-G6Q/3OOJ-G6Q_ligand.pdbqt | data/3O/3OOJ-G6Q/3OOJ-G6Q_target.pdbqt | data/3O/3OOJ-G6Q/3OOJ-G6Q_decoys.pdbqt | data/3O/3OOJ-G6Q/3OOJ-G6Q_decoy_scores.csv |
3O1C-ADN | data/3O/3O1C-ADN/3O1C-ADN_ligand.pdbqt | data/3O/3O1C-ADN/3O1C-ADN_target.pdbqt | data/3O/3O1C-ADN/3O1C-ADN_decoys.pdbqt | data/3O/3O1C-ADN/3O1C-ADN_decoy_scores.csv |
3OGN-3OG | data/3O/3OGN-3OG/3OGN-3OG_ligand.pdbqt | data/3O/3OGN-3OG/3OGN-3OG_target.pdbqt | data/3O/3OGN-3OG/3OGN-3OG_decoys.pdbqt | data/3O/3OGN-3OG/3OGN-3OG_decoy_scores.csv |
3O02-JN3 | data/3O/3O02-JN3/3O02-JN3_ligand.pdbqt | data/3O/3O02-JN3/3O02-JN3_target.pdbqt | data/3O/3O02-JN3/3O02-JN3_decoys.pdbqt | data/3O/3O02-JN3/3O02-JN3_decoy_scores.csv |
3OU7-SAM | data/3O/3OU7-SAM/3OU7-SAM_ligand.pdbqt | data/3O/3OU7-SAM/3OU7-SAM_target.pdbqt | data/3O/3OU7-SAM/3OU7-SAM_decoys.pdbqt | data/3O/3OU7-SAM/3OU7-SAM_decoy_scores.csv |
3O0I-P54 | data/3O/3O0I-P54/3O0I-P54_ligand.pdbqt | data/3O/3O0I-P54/3O0I-P54_target.pdbqt | data/3O/3O0I-P54/3O0I-P54_decoys.pdbqt | data/3O/3O0I-P54/3O0I-P54_decoy_scores.csv |
3ORT-AGS | data/3O/3ORT-AGS/3ORT-AGS_ligand.pdbqt | data/3O/3ORT-AGS/3ORT-AGS_target.pdbqt | data/3O/3ORT-AGS/3ORT-AGS_decoys.pdbqt | data/3O/3ORT-AGS/3ORT-AGS_decoy_scores.csv |
3OZY-DXL | data/3O/3OZY-DXL/3OZY-DXL_ligand.pdbqt | data/3O/3OZY-DXL/3OZY-DXL_target.pdbqt | data/3O/3OZY-DXL/3OZY-DXL_decoys.pdbqt | data/3O/3OZY-DXL/3OZY-DXL_decoy_scores.csv |
3OZM-DXL | data/3O/3OZM-DXL/3OZM-DXL_ligand.pdbqt | data/3O/3OZM-DXL/3OZM-DXL_target.pdbqt | data/3O/3OZM-DXL/3OZM-DXL_decoys.pdbqt | data/3O/3OZM-DXL/3OZM-DXL_decoy_scores.csv |
3OBT-SLB | data/3O/3OBT-SLB/3OBT-SLB_ligand.pdbqt | data/3O/3OBT-SLB/3OBT-SLB_target.pdbqt | data/3O/3OBT-SLB/3OBT-SLB_decoys.pdbqt | data/3O/3OBT-SLB/3OBT-SLB_decoy_scores.csv |
3OHF-3HF | data/3O/3OHF-3HF/3OHF-3HF_ligand.pdbqt | data/3O/3OHF-3HF/3OHF-3HF_target.pdbqt | data/3O/3OHF-3HF/3OHF-3HF_decoys.pdbqt | data/3O/3OHF-3HF/3OHF-3HF_decoy_scores.csv |
3OTU-J30 | data/3O/3OTU-J30/3OTU-J30_ligand.pdbqt | data/3O/3OTU-J30/3OTU-J30_target.pdbqt | data/3O/3OTU-J30/3OTU-J30_decoys.pdbqt | data/3O/3OTU-J30/3OTU-J30_decoy_scores.csv |
3OCZ-SRA | data/3O/3OCZ-SRA/3OCZ-SRA_ligand.pdbqt | data/3O/3OCZ-SRA/3OCZ-SRA_target.pdbqt | data/3O/3OCZ-SRA/3OCZ-SRA_decoys.pdbqt | data/3O/3OCZ-SRA/3OCZ-SRA_decoy_scores.csv |
3OGP-017 | data/3O/3OGP-017/3OGP-017_ligand.pdbqt | data/3O/3OGP-017/3OGP-017_target.pdbqt | data/3O/3OGP-017/3OGP-017_decoys.pdbqt | data/3O/3OGP-017/3OGP-017_decoy_scores.csv |
3OIV-GNP | data/3O/3OIV-GNP/3OIV-GNP_ligand.pdbqt | data/3O/3OIV-GNP/3OIV-GNP_target.pdbqt | data/3O/3OIV-GNP/3OIV-GNP_decoys.pdbqt | data/3O/3OIV-GNP/3OIV-GNP_decoy_scores.csv |
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