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 ⌀ |
|---|---|---|---|---|
3TZL-TRP | data/3T/3TZL-TRP/3TZL-TRP_ligand.pdbqt | data/3T/3TZL-TRP/3TZL-TRP_target.pdbqt | data/3T/3TZL-TRP/3TZL-TRP_decoys.pdbqt | data/3T/3TZL-TRP/3TZL-TRP_decoy_scores.csv |
3T85-SG7 | data/3T/3T85-SG7/3T85-SG7_ligand.pdbqt | data/3T/3T85-SG7/3T85-SG7_target.pdbqt | data/3T/3T85-SG7/3T85-SG7_decoys.pdbqt | data/3T/3T85-SG7/3T85-SG7_decoy_scores.csv |
3TZL-ADP | data/3T/3TZL-ADP/3TZL-ADP_ligand.pdbqt | data/3T/3TZL-ADP/3TZL-ADP_target.pdbqt | data/3T/3TZL-ADP/3TZL-ADP_decoys.pdbqt | data/3T/3TZL-ADP/3TZL-ADP_decoy_scores.csv |
3T96-IWD | data/3T/3T96-IWD/3T96-IWD_ligand.pdbqt | data/3T/3T96-IWD/3T96-IWD_target.pdbqt | data/3T/3T96-IWD/3T96-IWD_decoys.pdbqt | data/3T/3T96-IWD/3T96-IWD_decoy_scores.csv |
3TNL-NAD | data/3T/3TNL-NAD/3TNL-NAD_ligand.pdbqt | data/3T/3TNL-NAD/3TNL-NAD_target.pdbqt | data/3T/3TNL-NAD/3TNL-NAD_decoys.pdbqt | data/3T/3TNL-NAD/3TNL-NAD_decoy_scores.csv |
3TS4-EEG | data/3T/3TS4-EEG/3TS4-EEG_ligand.pdbqt | data/3T/3TS4-EEG/3TS4-EEG_target.pdbqt | data/3T/3TS4-EEG/3TS4-EEG_decoys.pdbqt | data/3T/3TS4-EEG/3TS4-EEG_decoy_scores.csv |
3TTJ-JBI | data/3T/3TTJ-JBI/3TTJ-JBI_ligand.pdbqt | data/3T/3TTJ-JBI/3TTJ-JBI_target.pdbqt | data/3T/3TTJ-JBI/3TTJ-JBI_decoys.pdbqt | data/3T/3TTJ-JBI/3TTJ-JBI_decoy_scores.csv |
3T14-LMT | data/3T/3T14-LMT/3T14-LMT_ligand.pdbqt | data/3T/3T14-LMT/3T14-LMT_target.pdbqt | data/3T/3T14-LMT/3T14-LMT_decoys.pdbqt | data/3T/3T14-LMT/3T14-LMT_decoy_scores.csv |
3T9Z-FLC | data/3T/3T9Z-FLC/3T9Z-FLC_ligand.pdbqt | data/3T/3T9Z-FLC/3T9Z-FLC_target.pdbqt | data/3T/3T9Z-FLC/3T9Z-FLC_decoys.pdbqt | data/3T/3T9Z-FLC/3T9Z-FLC_decoy_scores.csv |
3TEM-6A1 | data/3T/3TEM-6A1/3TEM-6A1_ligand.pdbqt | data/3T/3TEM-6A1/3TEM-6A1_target.pdbqt | data/3T/3TEM-6A1/3TEM-6A1_decoys.pdbqt | data/3T/3TEM-6A1/3TEM-6A1_decoy_scores.csv |
3TR9-PT1 | data/3T/3TR9-PT1/3TR9-PT1_ligand.pdbqt | data/3T/3TR9-PT1/3TR9-PT1_target.pdbqt | data/3T/3TR9-PT1/3TR9-PT1_decoys.pdbqt | data/3T/3TR9-PT1/3TR9-PT1_decoy_scores.csv |
3TG4-SAM | data/3T/3TG4-SAM/3TG4-SAM_ligand.pdbqt | data/3T/3TG4-SAM/3TG4-SAM_target.pdbqt | data/3T/3TG4-SAM/3TG4-SAM_decoys.pdbqt | data/3T/3TG4-SAM/3TG4-SAM_decoy_scores.csv |
3T94-MTA | data/3T/3T94-MTA/3T94-MTA_ligand.pdbqt | data/3T/3T94-MTA/3T94-MTA_target.pdbqt | data/3T/3T94-MTA/3T94-MTA_decoys.pdbqt | data/3T/3T94-MTA/3T94-MTA_decoy_scores.csv |
3TUT-ATP | data/3T/3TUT-ATP/3TUT-ATP_ligand.pdbqt | data/3T/3TUT-ATP/3TUT-ATP_target.pdbqt | data/3T/3TUT-ATP/3TUT-ATP_decoys.pdbqt | data/3T/3TUT-ATP/3TUT-ATP_decoy_scores.csv |
3TFJ-THG | data/3T/3TFJ-THG/3TFJ-THG_ligand.pdbqt | data/3T/3TFJ-THG/3TFJ-THG_target.pdbqt | data/3T/3TFJ-THG/3TFJ-THG_decoys.pdbqt | data/3T/3TFJ-THG/3TFJ-THG_decoy_scores.csv |
3T2D-P6F | data/3T/3T2D-P6F/3T2D-P6F_ligand.pdbqt | data/3T/3T2D-P6F/3T2D-P6F_target.pdbqt | data/3T/3T2D-P6F/3T2D-P6F_decoys.pdbqt | data/3T/3T2D-P6F/3T2D-P6F_decoy_scores.csv |
3T7A-ADP | data/3T/3T7A-ADP/3T7A-ADP_ligand.pdbqt | data/3T/3T7A-ADP/3T7A-ADP_target.pdbqt | data/3T/3T7A-ADP/3T7A-ADP_decoys.pdbqt | data/3T/3T7A-ADP/3T7A-ADP_decoy_scores.csv |
3TPS-DUP | data/3T/3TPS-DUP/3TPS-DUP_ligand.pdbqt | data/3T/3TPS-DUP/3TPS-DUP_target.pdbqt | data/3T/3TPS-DUP/3TPS-DUP_decoys.pdbqt | data/3T/3TPS-DUP/3TPS-DUP_decoy_scores.csv |
3TH5-GNP | data/3T/3TH5-GNP/3TH5-GNP_ligand.pdbqt | data/3T/3TH5-GNP/3TH5-GNP_target.pdbqt | data/3T/3TH5-GNP/3TH5-GNP_decoys.pdbqt | data/3T/3TH5-GNP/3TH5-GNP_decoy_scores.csv |
3TKF-I22 | data/3T/3TKF-I22/3TKF-I22_ligand.pdbqt | data/3T/3TKF-I22/3TKF-I22_target.pdbqt | data/3T/3TKF-I22/3TKF-I22_decoys.pdbqt | data/3T/3TKF-I22/3TKF-I22_decoy_scores.csv |
3TDJ-GLU | data/3T/3TDJ-GLU/3TDJ-GLU_ligand.pdbqt | data/3T/3TDJ-GLU/3TDJ-GLU_target.pdbqt | data/3T/3TDJ-GLU/3TDJ-GLU_decoys.pdbqt | data/3T/3TDJ-GLU/3TDJ-GLU_decoy_scores.csv |
3T44-IGP | data/3T/3T44-IGP/3T44-IGP_ligand.pdbqt | data/3T/3T44-IGP/3T44-IGP_target.pdbqt | data/3T/3T44-IGP/3T44-IGP_decoys.pdbqt | data/3T/3T44-IGP/3T44-IGP_decoy_scores.csv |
3T0D-149 | data/3T/3T0D-149/3T0D-149_ligand.pdbqt | data/3T/3T0D-149/3T0D-149_target.pdbqt | data/3T/3T0D-149/3T0D-149_decoys.pdbqt | data/3T/3T0D-149/3T0D-149_decoy_scores.csv |
3TDW-GDP | data/3T/3TDW-GDP/3TDW-GDP_ligand.pdbqt | data/3T/3TDW-GDP/3TDW-GDP_target.pdbqt | data/3T/3TDW-GDP/3TDW-GDP_decoys.pdbqt | data/3T/3TDW-GDP/3TDW-GDP_decoy_scores.csv |
3TG2-ISC | data/3T/3TG2-ISC/3TG2-ISC_ligand.pdbqt | data/3T/3TG2-ISC/3TG2-ISC_target.pdbqt | data/3T/3TG2-ISC/3TG2-ISC_decoys.pdbqt | data/3T/3TG2-ISC/3TG2-ISC_decoy_scores.csv |
3TMN-TRP | data/3T/3TMN-TRP/3TMN-TRP_ligand.pdbqt | data/3T/3TMN-TRP/3TMN-TRP_target.pdbqt | data/3T/3TMN-TRP/3TMN-TRP_decoys.pdbqt | data/3T/3TMN-TRP/3TMN-TRP_decoy_scores.csv |
3TKI-S25 | data/3T/3TKI-S25/3TKI-S25_ligand.pdbqt | data/3T/3TKI-S25/3TKI-S25_target.pdbqt | data/3T/3TKI-S25/3TKI-S25_decoys.pdbqt | data/3T/3TKI-S25/3TKI-S25_decoy_scores.csv |
3T4E-NAD | data/3T/3T4E-NAD/3T4E-NAD_ligand.pdbqt | data/3T/3T4E-NAD/3T4E-NAD_target.pdbqt | data/3T/3T4E-NAD/3T4E-NAD_decoys.pdbqt | data/3T/3T4E-NAD/3T4E-NAD_decoy_scores.csv |
3TKU-M77 | data/3T/3TKU-M77/3TKU-M77_ligand.pdbqt | data/3T/3TKU-M77/3TKU-M77_target.pdbqt | data/3T/3TKU-M77/3TKU-M77_decoys.pdbqt | data/3T/3TKU-M77/3TKU-M77_decoy_scores.csv |
3T9F-ADP | data/3T/3T9F-ADP/3T9F-ADP_ligand.pdbqt | data/3T/3T9F-ADP/3T9F-ADP_target.pdbqt | data/3T/3T9F-ADP/3T9F-ADP_decoys.pdbqt | data/3T/3T9F-ADP/3T9F-ADP_decoy_scores.csv |
3TLB-DSZ | data/3T/3TLB-DSZ/3TLB-DSZ_ligand.pdbqt | data/3T/3TLB-DSZ/3TLB-DSZ_target.pdbqt | data/3T/3TLB-DSZ/3TLB-DSZ_decoys.pdbqt | data/3T/3TLB-DSZ/3TLB-DSZ_decoy_scores.csv |
3TWP-PRP | data/3T/3TWP-PRP/3TWP-PRP_ligand.pdbqt | data/3T/3TWP-PRP/3TWP-PRP_target.pdbqt | data/3T/3TWP-PRP/3TWP-PRP_decoys.pdbqt | data/3T/3TWP-PRP/3TWP-PRP_decoy_scores.csv |
3T55-4RG | data/3T/3T55-4RG/3T55-4RG_ligand.pdbqt | data/3T/3T55-4RG/3T55-4RG_target.pdbqt | data/3T/3T55-4RG/3T55-4RG_decoys.pdbqt | data/3T/3T55-4RG/3T55-4RG_decoy_scores.csv |
3T6D-NS5 | data/3T/3T6D-NS5/3T6D-NS5_ligand.pdbqt | data/3T/3T6D-NS5/3T6D-NS5_target.pdbqt | data/3T/3T6D-NS5/3T6D-NS5_decoys.pdbqt | data/3T/3T6D-NS5/3T6D-NS5_decoy_scores.csv |
3T4Q-ZEA | data/3T/3T4Q-ZEA/3T4Q-ZEA_ligand.pdbqt | data/3T/3T4Q-ZEA/3T4Q-ZEA_target.pdbqt | data/3T/3T4Q-ZEA/3T4Q-ZEA_decoys.pdbqt | data/3T/3T4Q-ZEA/3T4Q-ZEA_decoy_scores.csv |
3T5F-M34 | data/3T/3T5F-M34/3T5F-M34_ligand.pdbqt | data/3T/3T5F-M34/3T5F-M34_target.pdbqt | data/3T/3T5F-M34/3T5F-M34_decoys.pdbqt | data/3T/3T5F-M34/3T5F-M34_decoy_scores.csv |
3T6I-NC8 | data/3T/3T6I-NC8/3T6I-NC8_ligand.pdbqt | data/3T/3T6I-NC8/3T6I-NC8_target.pdbqt | data/3T/3T6I-NC8/3T6I-NC8_decoys.pdbqt | data/3T/3T6I-NC8/3T6I-NC8_decoy_scores.csv |
3T6D-HTH | data/3T/3T6D-HTH/3T6D-HTH_ligand.pdbqt | data/3T/3T6D-HTH/3T6D-HTH_target.pdbqt | data/3T/3T6D-HTH/3T6D-HTH_decoys.pdbqt | data/3T/3T6D-HTH/3T6D-HTH_decoy_scores.csv |
3TLE-GSU | data/3T/3TLE-GSU/3TLE-GSU_ligand.pdbqt | data/3T/3TLE-GSU/3TLE-GSU_target.pdbqt | data/3T/3TLE-GSU/3TLE-GSU_decoys.pdbqt | data/3T/3TLE-GSU/3TLE-GSU_decoy_scores.csv |
3T0Z-ATP | data/3T/3T0Z-ATP/3T0Z-ATP_ligand.pdbqt | data/3T/3T0Z-ATP/3T0Z-ATP_target.pdbqt | data/3T/3T0Z-ATP/3T0Z-ATP_decoys.pdbqt | data/3T/3T0Z-ATP/3T0Z-ATP_decoy_scores.csv |
3T5G-GDP | data/3T/3T5G-GDP/3T5G-GDP_ligand.pdbqt | data/3T/3T5G-GDP/3T5G-GDP_target.pdbqt | data/3T/3T5G-GDP/3T5G-GDP_decoys.pdbqt | data/3T/3T5G-GDP/3T5G-GDP_decoy_scores.csv |
3TK2-PHE | data/3T/3TK2-PHE/3TK2-PHE_ligand.pdbqt | data/3T/3TK2-PHE/3TK2-PHE_target.pdbqt | data/3T/3TK2-PHE/3TK2-PHE_decoys.pdbqt | data/3T/3TK2-PHE/3TK2-PHE_decoy_scores.csv |
3TNL-SKM | data/3T/3TNL-SKM/3TNL-SKM_ligand.pdbqt | data/3T/3TNL-SKM/3TNL-SKM_target.pdbqt | data/3T/3TNL-SKM/3TNL-SKM_decoys.pdbqt | data/3T/3TNL-SKM/3TNL-SKM_decoy_scores.csv |
3T6I-Z82 | data/3T/3T6I-Z82/3T6I-Z82_ligand.pdbqt | data/3T/3T6I-Z82/3T6I-Z82_target.pdbqt | data/3T/3T6I-Z82/3T6I-Z82_decoys.pdbqt | data/3T/3T6I-Z82/3T6I-Z82_decoy_scores.csv |
3TPT-ADP | data/3T/3TPT-ADP/3TPT-ADP_ligand.pdbqt | data/3T/3TPT-ADP/3TPT-ADP_target.pdbqt | data/3T/3TPT-ADP/3TPT-ADP_decoys.pdbqt | data/3T/3TPT-ADP/3TPT-ADP_decoy_scores.csv |
3T0M-2CT | data/3T/3T0M-2CT/3T0M-2CT_ligand.pdbqt | data/3T/3T0M-2CT/3T0M-2CT_target.pdbqt | data/3T/3T0M-2CT/3T0M-2CT_decoys.pdbqt | data/3T/3T0M-2CT/3T0M-2CT_decoy_scores.csv |
3T4S-H35 | data/3T/3T4S-H35/3T4S-H35_ligand.pdbqt | data/3T/3T4S-H35/3T4S-H35_target.pdbqt | data/3T/3T4S-H35/3T4S-H35_decoys.pdbqt | data/3T/3T4S-H35/3T4S-H35_decoy_scores.csv |
3T8D-UBV | data/3T/3T8D-UBV/3T8D-UBV_ligand.pdbqt | data/3T/3T8D-UBV/3T8D-UBV_target.pdbqt | data/3T/3T8D-UBV/3T8D-UBV_decoys.pdbqt | data/3T/3T8D-UBV/3T8D-UBV_decoy_scores.csv |
3T0Q-ADP | data/3T/3T0Q-ADP/3T0Q-ADP_ligand.pdbqt | data/3T/3T0Q-ADP/3T0Q-ADP_target.pdbqt | data/3T/3T0Q-ADP/3T0Q-ADP_decoys.pdbqt | data/3T/3T0Q-ADP/3T0Q-ADP_decoy_scores.csv |
3TSA-GLC | data/3T/3TSA-GLC/3TSA-GLC_ligand.pdbqt | data/3T/3TSA-GLC/3TSA-GLC_target.pdbqt | data/3T/3TSA-GLC/3TSA-GLC_decoys.pdbqt | data/3T/3TSA-GLC/3TSA-GLC_decoy_scores.csv |
3T2Q-149 | data/3T/3T2Q-149/3T2Q-149_ligand.pdbqt | data/3T/3T2Q-149/3T2Q-149_target.pdbqt | data/3T/3T2Q-149/3T2Q-149_decoys.pdbqt | data/3T/3T2Q-149/3T2Q-149_decoy_scores.csv |
3TF6-DBH | data/3T/3TF6-DBH/3TF6-DBH_ligand.pdbqt | data/3T/3TF6-DBH/3TF6-DBH_target.pdbqt | null | null |
3T1M-DQT | data/3T/3T1M-DQT/3T1M-DQT_ligand.pdbqt | data/3T/3T1M-DQT/3T1M-DQT_target.pdbqt | data/3T/3T1M-DQT/3T1M-DQT_decoys.pdbqt | data/3T/3T1M-DQT/3T1M-DQT_decoy_scores.csv |
3TGW-AES | data/3T/3TGW-AES/3TGW-AES_ligand.pdbqt | data/3T/3TGW-AES/3TGW-AES_target.pdbqt | data/3T/3TGW-AES/3TGW-AES_decoys.pdbqt | data/3T/3TGW-AES/3TGW-AES_decoy_scores.csv |
3TB0-MN0 | data/3T/3TB0-MN0/3TB0-MN0_ligand.pdbqt | data/3T/3TB0-MN0/3TB0-MN0_target.pdbqt | data/3T/3TB0-MN0/3TB0-MN0_decoys.pdbqt | data/3T/3TB0-MN0/3TB0-MN0_decoy_scores.csv |
3T9U-CNI | data/3T/3T9U-CNI/3T9U-CNI_ligand.pdbqt | data/3T/3T9U-CNI/3T9U-CNI_target.pdbqt | data/3T/3T9U-CNI/3T9U-CNI_decoys.pdbqt | data/3T/3T9U-CNI/3T9U-CNI_decoy_scores.csv |
3TNF-GNP | data/3T/3TNF-GNP/3TNF-GNP_ligand.pdbqt | data/3T/3TNF-GNP/3TNF-GNP_target.pdbqt | data/3T/3TNF-GNP/3TNF-GNP_decoys.pdbqt | data/3T/3TNF-GNP/3TNF-GNP_decoy_scores.csv |
3TW6-BTI | data/3T/3TW6-BTI/3TW6-BTI_ligand.pdbqt | data/3T/3TW6-BTI/3TW6-BTI_target.pdbqt | data/3T/3TW6-BTI/3TW6-BTI_decoys.pdbqt | data/3T/3TW6-BTI/3TW6-BTI_decoy_scores.csv |
3TM4-SAM | data/3T/3TM4-SAM/3TM4-SAM_ligand.pdbqt | data/3T/3TM4-SAM/3TM4-SAM_target.pdbqt | data/3T/3TM4-SAM/3TM4-SAM_decoys.pdbqt | data/3T/3TM4-SAM/3TM4-SAM_decoy_scores.csv |
3T3U-BK6 | data/3T/3T3U-BK6/3T3U-BK6_ligand.pdbqt | data/3T/3T3U-BK6/3T3U-BK6_target.pdbqt | data/3T/3T3U-BK6/3T3U-BK6_decoys.pdbqt | data/3T/3T3U-BK6/3T3U-BK6_decoy_scores.csv |
3T0B-IPT | data/3T/3T0B-IPT/3T0B-IPT_ligand.pdbqt | data/3T/3T0B-IPT/3T0B-IPT_target.pdbqt | data/3T/3T0B-IPT/3T0B-IPT_decoys.pdbqt | data/3T/3T0B-IPT/3T0B-IPT_decoy_scores.csv |
3TW1-AHN | data/3T/3TW1-AHN/3TW1-AHN_ligand.pdbqt | data/3T/3TW1-AHN/3TW1-AHN_target.pdbqt | data/3T/3TW1-AHN/3TW1-AHN_decoys.pdbqt | data/3T/3TW1-AHN/3TW1-AHN_decoy_scores.csv |
3TZ5-CLT | data/3T/3TZ5-CLT/3TZ5-CLT_ligand.pdbqt | data/3T/3TZ5-CLT/3TZ5-CLT_target.pdbqt | data/3T/3TZ5-CLT/3TZ5-CLT_decoys.pdbqt | data/3T/3TZ5-CLT/3TZ5-CLT_decoy_scores.csv |
3T9C-IHP | data/3T/3T9C-IHP/3T9C-IHP_ligand.pdbqt | data/3T/3T9C-IHP/3T9C-IHP_target.pdbqt | data/3T/3T9C-IHP/3T9C-IHP_decoys.pdbqt | data/3T/3T9C-IHP/3T9C-IHP_decoy_scores.csv |
3TSU-ADP | data/3T/3TSU-ADP/3TSU-ADP_ligand.pdbqt | data/3T/3TSU-ADP/3TSU-ADP_target.pdbqt | data/3T/3TSU-ADP/3TSU-ADP_decoys.pdbqt | data/3T/3TSU-ADP/3TSU-ADP_decoy_scores.csv |
3TK1-GDP | data/3T/3TK1-GDP/3TK1-GDP_ligand.pdbqt | data/3T/3TK1-GDP/3TK1-GDP_target.pdbqt | data/3T/3TK1-GDP/3TK1-GDP_decoys.pdbqt | data/3T/3TK1-GDP/3TK1-GDP_decoy_scores.csv |
3TOG-079 | data/3T/3TOG-079/3TOG-079_ligand.pdbqt | data/3T/3TOG-079/3TOG-079_target.pdbqt | data/3T/3TOG-079/3TOG-079_decoys.pdbqt | data/3T/3TOG-079/3TOG-079_decoy_scores.csv |
3TLC-7MD | data/3T/3TLC-7MD/3TLC-7MD_ligand.pdbqt | data/3T/3TLC-7MD/3TLC-7MD_target.pdbqt | data/3T/3TLC-7MD/3TLC-7MD_decoys.pdbqt | data/3T/3TLC-7MD/3TLC-7MD_decoy_scores.csv |
3TGE-TGE | data/3T/3TGE-TGE/3TGE-TGE_ligand.pdbqt | data/3T/3TGE-TGE/3TGE-TGE_target.pdbqt | data/3T/3TGE-TGE/3TGE-TGE_decoys.pdbqt | data/3T/3TGE-TGE/3TGE-TGE_decoy_scores.csv |
3T4N-ADP | data/3T/3T4N-ADP/3T4N-ADP_ligand.pdbqt | data/3T/3T4N-ADP/3T4N-ADP_target.pdbqt | data/3T/3T4N-ADP/3T4N-ADP_decoys.pdbqt | data/3T/3T4N-ADP/3T4N-ADP_decoy_scores.csv |
3T25-BEN | data/3T/3T25-BEN/3T25-BEN_ligand.pdbqt | data/3T/3T25-BEN/3T25-BEN_target.pdbqt | data/3T/3T25-BEN/3T25-BEN_decoys.pdbqt | data/3T/3T25-BEN/3T25-BEN_decoy_scores.csv |
3TH2-BEN | data/3T/3TH2-BEN/3TH2-BEN_ligand.pdbqt | data/3T/3TH2-BEN/3TH2-BEN_target.pdbqt | data/3T/3TH2-BEN/3TH2-BEN_decoys.pdbqt | data/3T/3TH2-BEN/3TH2-BEN_decoy_scores.csv |
3T82-SG4 | data/3T/3T82-SG4/3T82-SG4_ligand.pdbqt | data/3T/3T82-SG4/3T82-SG4_target.pdbqt | data/3T/3T82-SG4/3T82-SG4_decoys.pdbqt | data/3T/3T82-SG4/3T82-SG4_decoy_scores.csv |
3TG5-SAH | data/3T/3TG5-SAH/3TG5-SAH_ligand.pdbqt | data/3T/3TG5-SAH/3TG5-SAH_target.pdbqt | data/3T/3TG5-SAH/3TG5-SAH_decoys.pdbqt | data/3T/3TG5-SAH/3TG5-SAH_decoy_scores.csv |
3TNZ-FMN | data/3T/3TNZ-FMN/3TNZ-FMN_ligand.pdbqt | data/3T/3TNZ-FMN/3TNZ-FMN_target.pdbqt | data/3T/3TNZ-FMN/3TNZ-FMN_decoys.pdbqt | data/3T/3TNZ-FMN/3TNZ-FMN_decoy_scores.csv |
3TJ2-TJ2 | data/3T/3TJ2-TJ2/3TJ2-TJ2_ligand.pdbqt | data/3T/3TJ2-TJ2/3TJ2-TJ2_target.pdbqt | data/3T/3TJ2-TJ2/3TJ2-TJ2_decoys.pdbqt | data/3T/3TJ2-TJ2/3TJ2-TJ2_decoy_scores.csv |
3T8O-ATP | data/3T/3T8O-ATP/3T8O-ATP_ligand.pdbqt | data/3T/3T8O-ATP/3T8O-ATP_target.pdbqt | data/3T/3T8O-ATP/3T8O-ATP_decoys.pdbqt | data/3T/3T8O-ATP/3T8O-ATP_decoy_scores.csv |
3TOS-SAH | data/3T/3TOS-SAH/3TOS-SAH_ligand.pdbqt | data/3T/3TOS-SAH/3TOS-SAH_target.pdbqt | data/3T/3TOS-SAH/3TOS-SAH_decoys.pdbqt | data/3T/3TOS-SAH/3TOS-SAH_decoy_scores.csv |
3THD-DGJ | data/3T/3THD-DGJ/3THD-DGJ_ligand.pdbqt | data/3T/3THD-DGJ/3THD-DGJ_target.pdbqt | data/3T/3THD-DGJ/3THD-DGJ_decoys.pdbqt | data/3T/3THD-DGJ/3THD-DGJ_decoy_scores.csv |
3TY3-GGG | data/3T/3TY3-GGG/3TY3-GGG_ligand.pdbqt | data/3T/3TY3-GGG/3TY3-GGG_target.pdbqt | data/3T/3TY3-GGG/3TY3-GGG_decoys.pdbqt | data/3T/3TY3-GGG/3TY3-GGG_decoy_scores.csv |
3TIT-G81 | data/3T/3TIT-G81/3TIT-G81_ligand.pdbqt | data/3T/3TIT-G81/3TIT-G81_target.pdbqt | data/3T/3TIT-G81/3TIT-G81_decoys.pdbqt | data/3T/3TIT-G81/3TIT-G81_decoy_scores.csv |
3TYN-CXW | data/3T/3TYN-CXW/3TYN-CXW_ligand.pdbqt | data/3T/3TYN-CXW/3TYN-CXW_target.pdbqt | data/3T/3TYN-CXW/3TYN-CXW_decoys.pdbqt | data/3T/3TYN-CXW/3TYN-CXW_decoy_scores.csv |
3T0R-PE4 | data/3T/3T0R-PE4/3T0R-PE4_ligand.pdbqt | data/3T/3T0R-PE4/3T0R-PE4_target.pdbqt | data/3T/3T0R-PE4/3T0R-PE4_decoys.pdbqt | data/3T/3T0R-PE4/3T0R-PE4_decoy_scores.csv |
3TYQ-HI4 | data/3T/3TYQ-HI4/3TYQ-HI4_ligand.pdbqt | data/3T/3TYQ-HI4/3TYQ-HI4_target.pdbqt | data/3T/3TYQ-HI4/3TYQ-HI4_decoys.pdbqt | data/3T/3TYQ-HI4/3TYQ-HI4_decoy_scores.csv |
3TYD-XHP | data/3T/3TYD-XHP/3TYD-XHP_ligand.pdbqt | data/3T/3TYD-XHP/3TYD-XHP_target.pdbqt | data/3T/3TYD-XHP/3TYD-XHP_decoys.pdbqt | data/3T/3TYD-XHP/3TYD-XHP_decoy_scores.csv |
3T0I-SAH | data/3T/3T0I-SAH/3T0I-SAH_ligand.pdbqt | data/3T/3T0I-SAH/3T0I-SAH_target.pdbqt | data/3T/3T0I-SAH/3T0I-SAH_decoys.pdbqt | data/3T/3T0I-SAH/3T0I-SAH_decoy_scores.csv |
3TFC-PEP | data/3T/3TFC-PEP/3TFC-PEP_ligand.pdbqt | data/3T/3TFC-PEP/3TFC-PEP_target.pdbqt | data/3T/3TFC-PEP/3TFC-PEP_decoys.pdbqt | data/3T/3TFC-PEP/3TFC-PEP_decoy_scores.csv |
3TIJ-URI | data/3T/3TIJ-URI/3TIJ-URI_ligand.pdbqt | data/3T/3TIJ-URI/3TIJ-URI_target.pdbqt | data/3T/3TIJ-URI/3TIJ-URI_decoys.pdbqt | data/3T/3TIJ-URI/3TIJ-URI_decoy_scores.csv |
3TYX-AMP | data/3T/3TYX-AMP/3TYX-AMP_ligand.pdbqt | data/3T/3TYX-AMP/3TYX-AMP_target.pdbqt | data/3T/3TYX-AMP/3TYX-AMP_decoys.pdbqt | data/3T/3TYX-AMP/3TYX-AMP_decoy_scores.csv |
3T0F-H6P | data/3T/3T0F-H6P/3T0F-H6P_ligand.pdbqt | data/3T/3T0F-H6P/3T0F-H6P_target.pdbqt | data/3T/3T0F-H6P/3T0F-H6P_decoys.pdbqt | data/3T/3T0F-H6P/3T0F-H6P_decoy_scores.csv |
3TKD-CYZ | data/3T/3TKD-CYZ/3TKD-CYZ_ligand.pdbqt | data/3T/3TKD-CYZ/3TKD-CYZ_target.pdbqt | data/3T/3TKD-CYZ/3TKD-CYZ_decoys.pdbqt | data/3T/3TKD-CYZ/3TKD-CYZ_decoy_scores.csv |
3T1A-5MA | data/3T/3T1A-5MA/3T1A-5MA_ligand.pdbqt | data/3T/3T1A-5MA/3T1A-5MA_target.pdbqt | data/3T/3T1A-5MA/3T1A-5MA_decoys.pdbqt | data/3T/3T1A-5MA/3T1A-5MA_decoy_scores.csv |
3TQR-NHE | data/3T/3TQR-NHE/3TQR-NHE_ligand.pdbqt | data/3T/3TQR-NHE/3TQR-NHE_target.pdbqt | data/3T/3TQR-NHE/3TQR-NHE_decoys.pdbqt | data/3T/3TQR-NHE/3TQR-NHE_decoy_scores.csv |
3TNZ-IYR | data/3T/3TNZ-IYR/3TNZ-IYR_ligand.pdbqt | data/3T/3TNZ-IYR/3TNZ-IYR_target.pdbqt | data/3T/3TNZ-IYR/3TNZ-IYR_decoys.pdbqt | data/3T/3TNZ-IYR/3TNZ-IYR_decoy_scores.csv |
3T2S-AGS | data/3T/3T2S-AGS/3T2S-AGS_ligand.pdbqt | data/3T/3T2S-AGS/3T2S-AGS_target.pdbqt | data/3T/3T2S-AGS/3T2S-AGS_decoys.pdbqt | data/3T/3T2S-AGS/3T2S-AGS_decoy_scores.csv |
3TM0-B31 | data/3T/3TM0-B31/3TM0-B31_ligand.pdbqt | data/3T/3TM0-B31/3TM0-B31_target.pdbqt | data/3T/3TM0-B31/3TM0-B31_decoys.pdbqt | data/3T/3TM0-B31/3TM0-B31_decoy_scores.csv |
3T29-BEN | data/3T/3T29-BEN/3T29-BEN_ligand.pdbqt | data/3T/3T29-BEN/3T29-BEN_target.pdbqt | data/3T/3T29-BEN/3T29-BEN_decoys.pdbqt | data/3T/3T29-BEN/3T29-BEN_decoy_scores.csv |
3TV1-AMP | data/3T/3TV1-AMP/3TV1-AMP_ligand.pdbqt | data/3T/3TV1-AMP/3TV1-AMP_target.pdbqt | data/3T/3TV1-AMP/3TV1-AMP_decoys.pdbqt | data/3T/3TV1-AMP/3TV1-AMP_decoy_scores.csv |
3TTA-UMP | data/3T/3TTA-UMP/3TTA-UMP_ligand.pdbqt | data/3T/3TTA-UMP/3TTA-UMP_target.pdbqt | data/3T/3TTA-UMP/3TTA-UMP_decoys.pdbqt | data/3T/3TTA-UMP/3TTA-UMP_decoy_scores.csv |
3TW2-AMP | data/3T/3TW2-AMP/3TW2-AMP_ligand.pdbqt | data/3T/3TW2-AMP/3TW2-AMP_target.pdbqt | data/3T/3TW2-AMP/3TW2-AMP_decoys.pdbqt | data/3T/3TW2-AMP/3TW2-AMP_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.