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 ⌀ |
|---|---|---|---|---|
3TH2-FUC | data/3T/3TH2-FUC/3TH2-FUC_ligand.pdbqt | data/3T/3TH2-FUC/3TH2-FUC_target.pdbqt | data/3T/3TH2-FUC/3TH2-FUC_decoys.pdbqt | data/3T/3TH2-FUC/3TH2-FUC_decoy_scores.csv |
3TYZ-PAB | data/3T/3TYZ-PAB/3TYZ-PAB_ligand.pdbqt | data/3T/3TYZ-PAB/3TYZ-PAB_target.pdbqt | data/3T/3TYZ-PAB/3TYZ-PAB_decoys.pdbqt | data/3T/3TYZ-PAB/3TYZ-PAB_decoy_scores.csv |
3TD9-PHE | data/3T/3TD9-PHE/3TD9-PHE_ligand.pdbqt | data/3T/3TD9-PHE/3TD9-PHE_target.pdbqt | data/3T/3TD9-PHE/3TD9-PHE_decoys.pdbqt | data/3T/3TD9-PHE/3TD9-PHE_decoy_scores.csv |
3TYE-YTZ | data/3T/3TYE-YTZ/3TYE-YTZ_ligand.pdbqt | data/3T/3TYE-YTZ/3TYE-YTZ_target.pdbqt | data/3T/3TYE-YTZ/3TYE-YTZ_decoys.pdbqt | data/3T/3TYE-YTZ/3TYE-YTZ_decoy_scores.csv |
3T7C-NAD | data/3T/3T7C-NAD/3T7C-NAD_ligand.pdbqt | data/3T/3T7C-NAD/3T7C-NAD_target.pdbqt | data/3T/3T7C-NAD/3T7C-NAD_decoys.pdbqt | data/3T/3T7C-NAD/3T7C-NAD_decoy_scores.csv |
3T1V-GDP | data/3T/3T1V-GDP/3T1V-GDP_ligand.pdbqt | data/3T/3T1V-GDP/3T1V-GDP_target.pdbqt | data/3T/3T1V-GDP/3T1V-GDP_decoys.pdbqt | data/3T/3T1V-GDP/3T1V-GDP_decoy_scores.csv |
3T1D-DBH | data/3T/3T1D-DBH/3T1D-DBH_ligand.pdbqt | data/3T/3T1D-DBH/3T1D-DBH_target.pdbqt | data/3T/3T1D-DBH/3T1D-DBH_decoys.pdbqt | data/3T/3T1D-DBH/3T1D-DBH_decoy_scores.csv |
3TMZ-06X | data/3T/3TMZ-06X/3TMZ-06X_ligand.pdbqt | data/3T/3TMZ-06X/3TMZ-06X_target.pdbqt | data/3T/3TMZ-06X/3TMZ-06X_decoys.pdbqt | data/3T/3TMZ-06X/3TMZ-06X_decoy_scores.csv |
3TCT-3MI | data/3T/3TCT-3MI/3TCT-3MI_ligand.pdbqt | data/3T/3TCT-3MI/3TCT-3MI_target.pdbqt | data/3T/3TCT-3MI/3TCT-3MI_decoys.pdbqt | data/3T/3TCT-3MI/3TCT-3MI_decoy_scores.csv |
3T3D-CJB | data/3T/3T3D-CJB/3T3D-CJB_ligand.pdbqt | data/3T/3T3D-CJB/3T3D-CJB_target.pdbqt | data/3T/3T3D-CJB/3T3D-CJB_decoys.pdbqt | data/3T/3T3D-CJB/3T3D-CJB_decoy_scores.csv |
3TLL-62D | data/3T/3TLL-62D/3TLL-62D_ligand.pdbqt | data/3T/3TLL-62D/3TLL-62D_target.pdbqt | data/3T/3TLL-62D/3TLL-62D_decoys.pdbqt | data/3T/3TLL-62D/3TLL-62D_decoy_scores.csv |
3TM5-SFG | data/3T/3TM5-SFG/3TM5-SFG_ligand.pdbqt | data/3T/3TM5-SFG/3TM5-SFG_target.pdbqt | data/3T/3TM5-SFG/3TM5-SFG_decoys.pdbqt | data/3T/3TM5-SFG/3TM5-SFG_decoy_scores.csv |
3T6C-GCO | data/3T/3T6C-GCO/3T6C-GCO_ligand.pdbqt | data/3T/3T6C-GCO/3T6C-GCO_target.pdbqt | data/3T/3T6C-GCO/3T6C-GCO_decoys.pdbqt | data/3T/3T6C-GCO/3T6C-GCO_decoy_scores.csv |
3TRL-UMP | data/3T/3TRL-UMP/3TRL-UMP_ligand.pdbqt | data/3T/3TRL-UMP/3TRL-UMP_target.pdbqt | data/3T/3TRL-UMP/3TRL-UMP_decoys.pdbqt | data/3T/3TRL-UMP/3TRL-UMP_decoy_scores.csv |
3TAY-BEN | data/3T/3TAY-BEN/3TAY-BEN_ligand.pdbqt | data/3T/3TAY-BEN/3TAY-BEN_target.pdbqt | data/3T/3TAY-BEN/3TAY-BEN_decoys.pdbqt | data/3T/3TAY-BEN/3TAY-BEN_decoy_scores.csv |
3T5G-FAR | data/3T/3T5G-FAR/3T5G-FAR_ligand.pdbqt | data/3T/3T5G-FAR/3T5G-FAR_target.pdbqt | data/3T/3T5G-FAR/3T5G-FAR_decoys.pdbqt | data/3T/3T5G-FAR/3T5G-FAR_decoy_scores.csv |
3T1K-ANP | data/3T/3T1K-ANP/3T1K-ANP_ligand.pdbqt | data/3T/3T1K-ANP/3T1K-ANP_target.pdbqt | data/3T/3T1K-ANP/3T1K-ANP_decoys.pdbqt | data/3T/3T1K-ANP/3T1K-ANP_decoy_scores.csv |
3TA0-ATP | data/3T/3TA0-ATP/3TA0-ATP_ligand.pdbqt | data/3T/3TA0-ATP/3TA0-ATP_target.pdbqt | data/3T/3TA0-ATP/3TA0-ATP_decoys.pdbqt | data/3T/3TA0-ATP/3TA0-ATP_decoy_scores.csv |
3TA6-FLC | data/3T/3TA6-FLC/3TA6-FLC_ligand.pdbqt | data/3T/3TA6-FLC/3TA6-FLC_target.pdbqt | data/3T/3TA6-FLC/3TA6-FLC_decoys.pdbqt | data/3T/3TA6-FLC/3TA6-FLC_decoy_scores.csv |
3TKA-SAM | data/3T/3TKA-SAM/3TKA-SAM_ligand.pdbqt | data/3T/3TKA-SAM/3TKA-SAM_target.pdbqt | data/3T/3TKA-SAM/3TKA-SAM_decoys.pdbqt | data/3T/3TKA-SAM/3TKA-SAM_decoy_scores.csv |
3TPK-BEN | data/3T/3TPK-BEN/3TPK-BEN_ligand.pdbqt | data/3T/3TPK-BEN/3TPK-BEN_target.pdbqt | data/3T/3TPK-BEN/3TPK-BEN_decoys.pdbqt | data/3T/3TPK-BEN/3TPK-BEN_decoy_scores.csv |
3TFP-03L | data/3T/3TFP-03L/3TFP-03L_ligand.pdbqt | data/3T/3TFP-03L/3TFP-03L_target.pdbqt | data/3T/3TFP-03L/3TFP-03L_decoys.pdbqt | data/3T/3TFP-03L/3TFP-03L_decoy_scores.csv |
3T2C-13P | data/3T/3T2C-13P/3T2C-13P_ligand.pdbqt | data/3T/3T2C-13P/3T2C-13P_target.pdbqt | data/3T/3T2C-13P/3T2C-13P_decoys.pdbqt | data/3T/3T2C-13P/3T2C-13P_decoy_scores.csv |
3T9T-IAQ | data/3T/3T9T-IAQ/3T9T-IAQ_ligand.pdbqt | data/3T/3T9T-IAQ/3T9T-IAQ_target.pdbqt | data/3T/3T9T-IAQ/3T9T-IAQ_decoys.pdbqt | data/3T/3T9T-IAQ/3T9T-IAQ_decoy_scores.csv |
3TQ9-MTX | data/3T/3TQ9-MTX/3TQ9-MTX_ligand.pdbqt | data/3T/3TQ9-MTX/3TQ9-MTX_target.pdbqt | data/3T/3TQ9-MTX/3TQ9-MTX_decoys.pdbqt | data/3T/3TQ9-MTX/3TQ9-MTX_decoy_scores.csv |
3TAH-BGO | data/3T/3TAH-BGO/3TAH-BGO_ligand.pdbqt | data/3T/3TAH-BGO/3TAH-BGO_target.pdbqt | data/3T/3TAH-BGO/3TAH-BGO_decoys.pdbqt | data/3T/3TAH-BGO/3TAH-BGO_decoy_scores.csv |
3TFN-2CJ | data/3T/3TFN-2CJ/3TFN-2CJ_ligand.pdbqt | data/3T/3TFN-2CJ/3TFN-2CJ_target.pdbqt | data/3T/3TFN-2CJ/3TFN-2CJ_decoys.pdbqt | data/3T/3TFN-2CJ/3TFN-2CJ_decoy_scores.csv |
3TU1-07G | data/3T/3TU1-07G/3TU1-07G_ligand.pdbqt | data/3T/3TU1-07G/3TU1-07G_target.pdbqt | data/3T/3TU1-07G/3TU1-07G_decoys.pdbqt | data/3T/3TU1-07G/3TU1-07G_decoy_scores.csv |
3TH4-FUC | data/3T/3TH4-FUC/3TH4-FUC_ligand.pdbqt | data/3T/3TH4-FUC/3TH4-FUC_target.pdbqt | data/3T/3TH4-FUC/3TH4-FUC_decoys.pdbqt | data/3T/3TH4-FUC/3TH4-FUC_decoy_scores.csv |
3TP6-THP | data/3T/3TP6-THP/3TP6-THP_ligand.pdbqt | data/3T/3TP6-THP/3TP6-THP_target.pdbqt | data/3T/3TP6-THP/3TP6-THP_decoys.pdbqt | data/3T/3TP6-THP/3TP6-THP_decoy_scores.csv |
3T70-DU4 | data/3T/3T70-DU4/3T70-DU4_ligand.pdbqt | data/3T/3T70-DU4/3T70-DU4_target.pdbqt | data/3T/3T70-DU4/3T70-DU4_decoys.pdbqt | data/3T/3T70-DU4/3T70-DU4_decoy_scores.csv |
3TIJ-DMU | data/3T/3TIJ-DMU/3TIJ-DMU_ligand.pdbqt | data/3T/3TIJ-DMU/3TIJ-DMU_target.pdbqt | data/3T/3TIJ-DMU/3TIJ-DMU_decoys.pdbqt | data/3T/3TIJ-DMU/3TIJ-DMU_decoy_scores.csv |
3TKG-ROC | data/3T/3TKG-ROC/3TKG-ROC_ligand.pdbqt | data/3T/3TKG-ROC/3TKG-ROC_target.pdbqt | data/3T/3TKG-ROC/3TKG-ROC_decoys.pdbqt | data/3T/3TKG-ROC/3TKG-ROC_decoy_scores.csv |
3T26-BEN | data/3T/3T26-BEN/3T26-BEN_ligand.pdbqt | data/3T/3T26-BEN/3T26-BEN_target.pdbqt | data/3T/3T26-BEN/3T26-BEN_decoys.pdbqt | data/3T/3T26-BEN/3T26-BEN_decoy_scores.csv |
3TK7-F6R | data/3T/3TK7-F6R/3TK7-F6R_ligand.pdbqt | data/3T/3TK7-F6R/3TK7-F6R_target.pdbqt | data/3T/3TK7-F6R/3TK7-F6R_decoys.pdbqt | data/3T/3TK7-F6R/3TK7-F6R_decoy_scores.csv |
3TX9-FMN | data/3T/3TX9-FMN/3TX9-FMN_ligand.pdbqt | data/3T/3TX9-FMN/3TX9-FMN_target.pdbqt | data/3T/3TX9-FMN/3TX9-FMN_decoys.pdbqt | data/3T/3TX9-FMN/3TX9-FMN_decoy_scores.csv |
3TWD-GOB | data/3T/3TWD-GOB/3TWD-GOB_ligand.pdbqt | data/3T/3TWD-GOB/3TWD-GOB_target.pdbqt | data/3T/3TWD-GOB/3TWD-GOB_decoys.pdbqt | data/3T/3TWD-GOB/3TWD-GOB_decoy_scores.csv |
3T12-GDP | data/3T/3T12-GDP/3T12-GDP_ligand.pdbqt | data/3T/3T12-GDP/3T12-GDP_target.pdbqt | null | null |
3TJS-D0R | data/3T/3TJS-D0R/3TJS-D0R_ligand.pdbqt | data/3T/3TJS-D0R/3TJS-D0R_target.pdbqt | data/3T/3TJS-D0R/3TJS-D0R_decoys.pdbqt | data/3T/3TJS-D0R/3TJS-D0R_decoy_scores.csv |
3TR5-GDP | data/3T/3TR5-GDP/3TR5-GDP_ligand.pdbqt | data/3T/3TR5-GDP/3TR5-GDP_target.pdbqt | data/3T/3TR5-GDP/3TR5-GDP_decoys.pdbqt | data/3T/3TR5-GDP/3TR5-GDP_decoy_scores.csv |
3TWX-P6G | data/3T/3TWX-P6G/3TWX-P6G_ligand.pdbqt | data/3T/3TWX-P6G/3TWX-P6G_target.pdbqt | data/3T/3TWX-P6G/3TWX-P6G_decoys.pdbqt | data/3T/3TWX-P6G/3TWX-P6G_decoy_scores.csv |
3T4H-MD5 | data/3T/3T4H-MD5/3T4H-MD5_ligand.pdbqt | data/3T/3T4H-MD5/3T4H-MD5_target.pdbqt | data/3T/3T4H-MD5/3T4H-MD5_decoys.pdbqt | data/3T/3T4H-MD5/3T4H-MD5_decoy_scores.csv |
3T44-BE2 | data/3T/3T44-BE2/3T44-BE2_ligand.pdbqt | data/3T/3T44-BE2/3T44-BE2_target.pdbqt | data/3T/3T44-BE2/3T44-BE2_decoys.pdbqt | data/3T/3T44-BE2/3T44-BE2_decoy_scores.csv |
3TYL-H4B | data/3T/3TYL-H4B/3TYL-H4B_ligand.pdbqt | data/3T/3TYL-H4B/3TYL-H4B_target.pdbqt | data/3T/3TYL-H4B/3TYL-H4B_decoys.pdbqt | data/3T/3TYL-H4B/3TYL-H4B_decoy_scores.csv |
3T5Z-B09 | data/3T/3T5Z-B09/3T5Z-B09_ligand.pdbqt | data/3T/3T5Z-B09/3T5Z-B09_target.pdbqt | data/3T/3T5Z-B09/3T5Z-B09_decoys.pdbqt | data/3T/3T5Z-B09/3T5Z-B09_decoy_scores.csv |
3T7X-4SH | data/3T/3T7X-4SH/3T7X-4SH_ligand.pdbqt | data/3T/3T7X-4SH/3T7X-4SH_target.pdbqt | data/3T/3T7X-4SH/3T7X-4SH_decoys.pdbqt | data/3T/3T7X-4SH/3T7X-4SH_decoy_scores.csv |
3T1D-TD1 | data/3T/3T1D-TD1/3T1D-TD1_ligand.pdbqt | data/3T/3T1D-TD1/3T1D-TD1_target.pdbqt | data/3T/3T1D-TD1/3T1D-TD1_decoys.pdbqt | data/3T/3T1D-TD1/3T1D-TD1_decoy_scores.csv |
3TEG-DAH | data/3T/3TEG-DAH/3TEG-DAH_ligand.pdbqt | data/3T/3TEG-DAH/3TEG-DAH_target.pdbqt | data/3T/3TEG-DAH/3TEG-DAH_decoys.pdbqt | data/3T/3TEG-DAH/3TEG-DAH_decoy_scores.csv |
3TOS-GLU | data/3T/3TOS-GLU/3TOS-GLU_ligand.pdbqt | data/3T/3TOS-GLU/3TOS-GLU_target.pdbqt | data/3T/3TOS-GLU/3TOS-GLU_decoys.pdbqt | data/3T/3TOS-GLU/3TOS-GLU_decoy_scores.csv |
3TGW-P33 | data/3T/3TGW-P33/3TGW-P33_ligand.pdbqt | data/3T/3TGW-P33/3TGW-P33_target.pdbqt | data/3T/3TGW-P33/3TGW-P33_decoys.pdbqt | data/3T/3TGW-P33/3TGW-P33_decoy_scores.csv |
3T8G-UBT | data/3T/3T8G-UBT/3T8G-UBT_ligand.pdbqt | data/3T/3T8G-UBT/3T8G-UBT_target.pdbqt | data/3T/3T8G-UBT/3T8G-UBT_decoys.pdbqt | data/3T/3T8G-UBT/3T8G-UBT_decoy_scores.csv |
3TL1-JRO | data/3T/3TL1-JRO/3TL1-JRO_ligand.pdbqt | data/3T/3TL1-JRO/3TL1-JRO_target.pdbqt | data/3T/3TL1-JRO/3TL1-JRO_decoys.pdbqt | data/3T/3TL1-JRO/3TL1-JRO_decoy_scores.csv |
3TWS-PE8 | data/3T/3TWS-PE8/3TWS-PE8_ligand.pdbqt | data/3T/3TWS-PE8/3TWS-PE8_target.pdbqt | data/3T/3TWS-PE8/3TWS-PE8_decoys.pdbqt | data/3T/3TWS-PE8/3TWS-PE8_decoy_scores.csv |
3TKA-CTN | data/3T/3TKA-CTN/3TKA-CTN_ligand.pdbqt | data/3T/3TKA-CTN/3TKA-CTN_target.pdbqt | data/3T/3TKA-CTN/3TKA-CTN_decoys.pdbqt | data/3T/3TKA-CTN/3TKA-CTN_decoy_scores.csv |
3TH8-TH9 | data/3T/3TH8-TH9/3TH8-TH9_ligand.pdbqt | data/3T/3TH8-TH9/3TH8-TH9_target.pdbqt | data/3T/3TH8-TH9/3TH8-TH9_decoys.pdbqt | data/3T/3TH8-TH9/3TH8-TH9_decoy_scores.csv |
3TPY-UMP | data/3T/3TPY-UMP/3TPY-UMP_ligand.pdbqt | data/3T/3TPY-UMP/3TPY-UMP_target.pdbqt | data/3T/3TPY-UMP/3TPY-UMP_decoys.pdbqt | data/3T/3TPY-UMP/3TPY-UMP_decoy_scores.csv |
3TJ7-AMP | data/3T/3TJ7-AMP/3TJ7-AMP_ligand.pdbqt | data/3T/3TJ7-AMP/3TJ7-AMP_target.pdbqt | data/3T/3TJ7-AMP/3TJ7-AMP_decoys.pdbqt | data/3T/3TJ7-AMP/3TJ7-AMP_decoy_scores.csv |
3TW6-ADP | data/3T/3TW6-ADP/3TW6-ADP_ligand.pdbqt | data/3T/3TW6-ADP/3TW6-ADP_target.pdbqt | data/3T/3TW6-ADP/3TW6-ADP_decoys.pdbqt | data/3T/3TW6-ADP/3TW6-ADP_decoy_scores.csv |
3TP8-THP | data/3T/3TP8-THP/3TP8-THP_ligand.pdbqt | data/3T/3TP8-THP/3TP8-THP_target.pdbqt | data/3T/3TP8-THP/3TP8-THP_decoys.pdbqt | data/3T/3TP8-THP/3TP8-THP_decoy_scores.csv |
3TSL-UMP | data/3T/3TSL-UMP/3TSL-UMP_ligand.pdbqt | data/3T/3TSL-UMP/3TSL-UMP_target.pdbqt | data/3T/3TSL-UMP/3TSL-UMP_decoys.pdbqt | data/3T/3TSL-UMP/3TSL-UMP_decoy_scores.csv |
3T1T-GDP | data/3T/3T1T-GDP/3T1T-GDP_ligand.pdbqt | data/3T/3T1T-GDP/3T1T-GDP_target.pdbqt | data/3T/3T1T-GDP/3T1T-GDP_decoys.pdbqt | data/3T/3T1T-GDP/3T1T-GDP_decoy_scores.csv |
3TO3-ATP | data/3T/3TO3-ATP/3TO3-ATP_ligand.pdbqt | data/3T/3TO3-ATP/3TO3-ATP_target.pdbqt | data/3T/3TO3-ATP/3TO3-ATP_decoys.pdbqt | data/3T/3TO3-ATP/3TO3-ATP_decoy_scores.csv |
3TUB-FPU | data/3T/3TUB-FPU/3TUB-FPU_ligand.pdbqt | data/3T/3TUB-FPU/3TUB-FPU_target.pdbqt | data/3T/3TUB-FPU/3TUB-FPU_decoys.pdbqt | data/3T/3TUB-FPU/3TUB-FPU_decoy_scores.csv |
3TK5-D1Q | data/3T/3TK5-D1Q/3TK5-D1Q_ligand.pdbqt | data/3T/3TK5-D1Q/3TK5-D1Q_target.pdbqt | data/3T/3TK5-D1Q/3TK5-D1Q_decoys.pdbqt | data/3T/3TK5-D1Q/3TK5-D1Q_decoy_scores.csv |
3T7B-GLU | data/3T/3T7B-GLU/3T7B-GLU_ligand.pdbqt | data/3T/3T7B-GLU/3T7B-GLU_target.pdbqt | data/3T/3T7B-GLU/3T7B-GLU_decoys.pdbqt | data/3T/3T7B-GLU/3T7B-GLU_decoy_scores.csv |
3T7N-UDP | data/3T/3T7N-UDP/3T7N-UDP_ligand.pdbqt | data/3T/3T7N-UDP/3T7N-UDP_target.pdbqt | data/3T/3T7N-UDP/3T7N-UDP_decoys.pdbqt | data/3T/3T7N-UDP/3T7N-UDP_decoy_scores.csv |
3TYC-XHP | data/3T/3TYC-XHP/3TYC-XHP_ligand.pdbqt | data/3T/3TYC-XHP/3TYC-XHP_target.pdbqt | data/3T/3TYC-XHP/3TYC-XHP_decoys.pdbqt | data/3T/3TYC-XHP/3TYC-XHP_decoy_scores.csv |
3TD4-API | data/3T/3TD4-API/3TD4-API_ligand.pdbqt | data/3T/3TD4-API/3TD4-API_target.pdbqt | data/3T/3TD4-API/3TD4-API_decoys.pdbqt | data/3T/3TD4-API/3TD4-API_decoy_scores.csv |
3TOZ-NAD | data/3T/3TOZ-NAD/3TOZ-NAD_ligand.pdbqt | data/3T/3TOZ-NAD/3TOZ-NAD_target.pdbqt | data/3T/3TOZ-NAD/3TOZ-NAD_decoys.pdbqt | data/3T/3TOZ-NAD/3TOZ-NAD_decoy_scores.csv |
3TVQ-DQH | data/3T/3TVQ-DQH/3TVQ-DQH_ligand.pdbqt | data/3T/3TVQ-DQH/3TVQ-DQH_target.pdbqt | data/3T/3TVQ-DQH/3TVQ-DQH_decoys.pdbqt | data/3T/3TVQ-DQH/3TVQ-DQH_decoy_scores.csv |
3T5I-FAR | data/3T/3T5I-FAR/3T5I-FAR_ligand.pdbqt | data/3T/3T5I-FAR/3T5I-FAR_target.pdbqt | data/3T/3T5I-FAR/3T5I-FAR_decoys.pdbqt | data/3T/3T5I-FAR/3T5I-FAR_decoy_scores.csv |
3TYO-H4B | data/3T/3TYO-H4B/3TYO-H4B_ligand.pdbqt | data/3T/3TYO-H4B/3TYO-H4B_target.pdbqt | data/3T/3TYO-H4B/3TYO-H4B_decoys.pdbqt | data/3T/3TYO-H4B/3TYO-H4B_decoy_scores.csv |
3TA1-ADP | data/3T/3TA1-ADP/3TA1-ADP_ligand.pdbqt | data/3T/3TA1-ADP/3TA1-ADP_target.pdbqt | data/3T/3TA1-ADP/3TA1-ADP_decoys.pdbqt | data/3T/3TA1-ADP/3TA1-ADP_decoy_scores.csv |
3T0V-PE3 | data/3T/3T0V-PE3/3T0V-PE3_ligand.pdbqt | data/3T/3T0V-PE3/3T0V-PE3_target.pdbqt | data/3T/3T0V-PE3/3T0V-PE3_decoys.pdbqt | data/3T/3T0V-PE3/3T0V-PE3_decoy_scores.csv |
3TTF-AMP | data/3T/3TTF-AMP/3TTF-AMP_ligand.pdbqt | data/3T/3TTF-AMP/3TTF-AMP_target.pdbqt | data/3T/3TTF-AMP/3TTF-AMP_decoys.pdbqt | data/3T/3TTF-AMP/3TTF-AMP_decoy_scores.csv |
3T9C-ANP | data/3T/3T9C-ANP/3T9C-ANP_ligand.pdbqt | data/3T/3T9C-ANP/3T9C-ANP_target.pdbqt | data/3T/3T9C-ANP/3T9C-ANP_decoys.pdbqt | data/3T/3T9C-ANP/3T9C-ANP_decoy_scores.csv |
3TZY-PLM | data/3T/3TZY-PLM/3TZY-PLM_ligand.pdbqt | data/3T/3TZY-PLM/3TZY-PLM_target.pdbqt | data/3T/3TZY-PLM/3TZY-PLM_decoys.pdbqt | data/3T/3TZY-PLM/3TZY-PLM_decoy_scores.csv |
3T6E-DGA | data/3T/3T6E-DGA/3T6E-DGA_ligand.pdbqt | data/3T/3T6E-DGA/3T6E-DGA_target.pdbqt | data/3T/3T6E-DGA/3T6E-DGA_decoys.pdbqt | data/3T/3T6E-DGA/3T6E-DGA_decoy_scores.csv |
3T0W-PE3 | data/3T/3T0W-PE3/3T0W-PE3_ligand.pdbqt | data/3T/3T0W-PE3/3T0W-PE3_target.pdbqt | data/3T/3T0W-PE3/3T0W-PE3_decoys.pdbqt | data/3T/3T0W-PE3/3T0W-PE3_decoy_scores.csv |
3T9B-ANP | data/3T/3T9B-ANP/3T9B-ANP_ligand.pdbqt | data/3T/3T9B-ANP/3T9B-ANP_target.pdbqt | data/3T/3T9B-ANP/3T9B-ANP_decoys.pdbqt | data/3T/3T9B-ANP/3T9B-ANP_decoy_scores.csv |
3TM2-TXI | data/3T/3TM2-TXI/3TM2-TXI_ligand.pdbqt | data/3T/3TM2-TXI/3TM2-TXI_target.pdbqt | data/3T/3TM2-TXI/3TM2-TXI_decoys.pdbqt | data/3T/3TM2-TXI/3TM2-TXI_decoy_scores.csv |
3T1O-GDP | data/3T/3T1O-GDP/3T1O-GDP_ligand.pdbqt | data/3T/3T1O-GDP/3T1O-GDP_target.pdbqt | data/3T/3T1O-GDP/3T1O-GDP_decoys.pdbqt | data/3T/3T1O-GDP/3T1O-GDP_decoy_scores.csv |
3TQ5-UMP | data/3T/3TQ5-UMP/3TQ5-UMP_ligand.pdbqt | data/3T/3TQ5-UMP/3TQ5-UMP_target.pdbqt | data/3T/3TQ5-UMP/3TQ5-UMP_decoys.pdbqt | data/3T/3TQ5-UMP/3TQ5-UMP_decoy_scores.csv |
3TFZ-CXS | data/3T/3TFZ-CXS/3TFZ-CXS_ligand.pdbqt | data/3T/3TFZ-CXS/3TFZ-CXS_target.pdbqt | data/3T/3TFZ-CXS/3TFZ-CXS_decoys.pdbqt | data/3T/3TFZ-CXS/3TFZ-CXS_decoy_scores.csv |
3T3V-BK4 | data/3T/3T3V-BK4/3T3V-BK4_ligand.pdbqt | data/3T/3T3V-BK4/3T3V-BK4_target.pdbqt | data/3T/3T3V-BK4/3T3V-BK4_decoys.pdbqt | data/3T/3T3V-BK4/3T3V-BK4_decoy_scores.csv |
3T3Y-MD6 | data/3T/3T3Y-MD6/3T3Y-MD6_ligand.pdbqt | data/3T/3T3Y-MD6/3T3Y-MD6_target.pdbqt | data/3T/3T3Y-MD6/3T3Y-MD6_decoys.pdbqt | data/3T/3T3Y-MD6/3T3Y-MD6_decoy_scores.csv |
3T73-UBX | data/3T/3T73-UBX/3T73-UBX_ligand.pdbqt | data/3T/3T73-UBX/3T73-UBX_target.pdbqt | data/3T/3T73-UBX/3T73-UBX_decoys.pdbqt | data/3T/3T73-UBX/3T73-UBX_decoy_scores.csv |
3TQ4-UMP | data/3T/3TQ4-UMP/3TQ4-UMP_ligand.pdbqt | data/3T/3TQ4-UMP/3TQ4-UMP_target.pdbqt | data/3T/3TQ4-UMP/3TQ4-UMP_decoys.pdbqt | data/3T/3TQ4-UMP/3TQ4-UMP_decoy_scores.csv |
3TNJ-AMP | data/3T/3TNJ-AMP/3TNJ-AMP_ligand.pdbqt | data/3T/3TNJ-AMP/3TNJ-AMP_target.pdbqt | data/3T/3TNJ-AMP/3TNJ-AMP_decoys.pdbqt | data/3T/3TNJ-AMP/3TNJ-AMP_decoy_scores.csv |
3T87-UBZ | data/3T/3T87-UBZ/3T87-UBZ_ligand.pdbqt | data/3T/3T87-UBZ/3T87-UBZ_target.pdbqt | data/3T/3T87-UBZ/3T87-UBZ_decoys.pdbqt | data/3T/3T87-UBZ/3T87-UBZ_decoy_scores.csv |
3T7S-SAM | data/3T/3T7S-SAM/3T7S-SAM_ligand.pdbqt | data/3T/3T7S-SAM/3T7S-SAM_target.pdbqt | data/3T/3T7S-SAM/3T7S-SAM_decoys.pdbqt | data/3T/3T7S-SAM/3T7S-SAM_decoy_scores.csv |
3TVC-E3P | data/3T/3TVC-E3P/3TVC-E3P_ligand.pdbqt | data/3T/3TVC-E3P/3TVC-E3P_target.pdbqt | data/3T/3TVC-E3P/3TVC-E3P_decoys.pdbqt | data/3T/3TVC-E3P/3TVC-E3P_decoy_scores.csv |
3T3Q-9PL | data/3T/3T3Q-9PL/3T3Q-9PL_ligand.pdbqt | data/3T/3T3Q-9PL/3T3Q-9PL_target.pdbqt | data/3T/3T3Q-9PL/3T3Q-9PL_decoys.pdbqt | data/3T/3T3Q-9PL/3T3Q-9PL_decoy_scores.csv |
3TDB-3TB | data/3T/3TDB-3TB/3TDB-3TB_ligand.pdbqt | data/3T/3TDB-3TB/3TDB-3TB_target.pdbqt | data/3T/3TDB-3TB/3TDB-3TB_decoys.pdbqt | data/3T/3TDB-3TB/3TDB-3TB_decoy_scores.csv |
3TKL-GTP | data/3T/3TKL-GTP/3TKL-GTP_ligand.pdbqt | data/3T/3TKL-GTP/3TKL-GTP_target.pdbqt | data/3T/3TKL-GTP/3TKL-GTP_decoys.pdbqt | data/3T/3TKL-GTP/3TKL-GTP_decoy_scores.csv |
3T24-C8E | data/3T/3T24-C8E/3T24-C8E_ligand.pdbqt | data/3T/3T24-C8E/3T24-C8E_target.pdbqt | data/3T/3T24-C8E/3T24-C8E_decoys.pdbqt | data/3T/3T24-C8E/3T24-C8E_decoy_scores.csv |
3T5M-AMP | data/3T/3T5M-AMP/3T5M-AMP_ligand.pdbqt | data/3T/3T5M-AMP/3T5M-AMP_target.pdbqt | data/3T/3T5M-AMP/3T5M-AMP_decoys.pdbqt | data/3T/3T5M-AMP/3T5M-AMP_decoy_scores.csv |
3TY0-082 | data/3T/3TY0-082/3TY0-082_ligand.pdbqt | data/3T/3TY0-082/3TY0-082_target.pdbqt | data/3T/3TY0-082/3TY0-082_decoys.pdbqt | data/3T/3TY0-082/3TY0-082_decoy_scores.csv |
3TSQ-CA0 | data/3T/3TSQ-CA0/3TSQ-CA0_ligand.pdbqt | data/3T/3TSQ-CA0/3TSQ-CA0_target.pdbqt | data/3T/3TSQ-CA0/3TSQ-CA0_decoys.pdbqt | data/3T/3TSQ-CA0/3TSQ-CA0_decoy_scores.csv |
3T6E-HTO | data/3T/3T6E-HTO/3T6E-HTO_ligand.pdbqt | data/3T/3T6E-HTO/3T6E-HTO_target.pdbqt | data/3T/3T6E-HTO/3T6E-HTO_decoys.pdbqt | data/3T/3T6E-HTO/3T6E-HTO_decoy_scores.csv |
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