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 ⌀ |
|---|---|---|---|---|
4FYW-CTP | data/4F/4FYW-CTP/4FYW-CTP_ligand.pdbqt | data/4F/4FYW-CTP/4FYW-CTP_target.pdbqt | data/4F/4FYW-CTP/4FYW-CTP_decoys.pdbqt | data/4F/4FYW-CTP/4FYW-CTP_decoy_scores.csv |
4FOF-VRB | data/4F/4FOF-VRB/4FOF-VRB_ligand.pdbqt | data/4F/4FOF-VRB/4FOF-VRB_target.pdbqt | data/4F/4FOF-VRB/4FOF-VRB_decoys.pdbqt | data/4F/4FOF-VRB/4FOF-VRB_decoy_scores.csv |
4FCE-GP1 | data/4F/4FCE-GP1/4FCE-GP1_ligand.pdbqt | data/4F/4FCE-GP1/4FCE-GP1_target.pdbqt | data/4F/4FCE-GP1/4FCE-GP1_decoys.pdbqt | data/4F/4FCE-GP1/4FCE-GP1_decoy_scores.csv |
4F0E-0RU | data/4F/4F0E-0RU/4F0E-0RU_ligand.pdbqt | data/4F/4F0E-0RU/4F0E-0RU_target.pdbqt | data/4F/4F0E-0RU/4F0E-0RU_decoys.pdbqt | data/4F/4F0E-0RU/4F0E-0RU_decoy_scores.csv |
4F42-MNB | data/4F/4F42-MNB/4F42-MNB_ligand.pdbqt | data/4F/4F42-MNB/4F42-MNB_target.pdbqt | data/4F/4F42-MNB/4F42-MNB_decoys.pdbqt | data/4F/4F42-MNB/4F42-MNB_decoy_scores.csv |
4FFP-ADP | data/4F/4FFP-ADP/4FFP-ADP_ligand.pdbqt | data/4F/4FFP-ADP/4FFP-ADP_target.pdbqt | data/4F/4FFP-ADP/4FFP-ADP_decoys.pdbqt | data/4F/4FFP-ADP/4FFP-ADP_decoy_scores.csv |
4FDU-IHS | data/4F/4FDU-IHS/4FDU-IHS_ligand.pdbqt | data/4F/4FDU-IHS/4FDU-IHS_target.pdbqt | data/4F/4FDU-IHS/4FDU-IHS_decoys.pdbqt | data/4F/4FDU-IHS/4FDU-IHS_decoy_scores.csv |
4FOX-D16 | data/4F/4FOX-D16/4FOX-D16_ligand.pdbqt | data/4F/4FOX-D16/4FOX-D16_target.pdbqt | data/4F/4FOX-D16/4FOX-D16_decoys.pdbqt | data/4F/4FOX-D16/4FOX-D16_decoy_scores.csv |
4FAI-PBD | data/4F/4FAI-PBD/4FAI-PBD_ligand.pdbqt | data/4F/4FAI-PBD/4FAI-PBD_target.pdbqt | data/4F/4FAI-PBD/4FAI-PBD_decoys.pdbqt | data/4F/4FAI-PBD/4FAI-PBD_decoy_scores.csv |
4FH7-TBP | data/4F/4FH7-TBP/4FH7-TBP_ligand.pdbqt | data/4F/4FH7-TBP/4FH7-TBP_target.pdbqt | data/4F/4FH7-TBP/4FH7-TBP_decoys.pdbqt | data/4F/4FH7-TBP/4FH7-TBP_decoy_scores.csv |
4FOS-SKM | data/4F/4FOS-SKM/4FOS-SKM_ligand.pdbqt | data/4F/4FOS-SKM/4FOS-SKM_target.pdbqt | data/4F/4FOS-SKM/4FOS-SKM_decoys.pdbqt | data/4F/4FOS-SKM/4FOS-SKM_decoy_scores.csv |
4FFO-ADP | data/4F/4FFO-ADP/4FFO-ADP_ligand.pdbqt | data/4F/4FFO-ADP/4FFO-ADP_target.pdbqt | data/4F/4FFO-ADP/4FFO-ADP_decoys.pdbqt | data/4F/4FFO-ADP/4FFO-ADP_decoy_scores.csv |
4FCQ-2N6 | data/4F/4FCQ-2N6/4FCQ-2N6_ligand.pdbqt | data/4F/4FCQ-2N6/4FCQ-2N6_target.pdbqt | data/4F/4FCQ-2N6/4FCQ-2N6_decoys.pdbqt | data/4F/4FCQ-2N6/4FCQ-2N6_decoy_scores.csv |
4F3X-NAD | data/4F/4F3X-NAD/4F3X-NAD_ligand.pdbqt | data/4F/4F3X-NAD/4F3X-NAD_target.pdbqt | data/4F/4F3X-NAD/4F3X-NAD_decoys.pdbqt | data/4F/4F3X-NAD/4F3X-NAD_decoy_scores.csv |
4FRM-GAL | data/4F/4FRM-GAL/4FRM-GAL_ligand.pdbqt | data/4F/4FRM-GAL/4FRM-GAL_target.pdbqt | data/4F/4FRM-GAL/4FRM-GAL_decoys.pdbqt | data/4F/4FRM-GAL/4FRM-GAL_decoy_scores.csv |
4FFM-ADP | data/4F/4FFM-ADP/4FFM-ADP_ligand.pdbqt | data/4F/4FFM-ADP/4FFM-ADP_target.pdbqt | data/4F/4FFM-ADP/4FFM-ADP_decoys.pdbqt | data/4F/4FFM-ADP/4FFM-ADP_decoy_scores.csv |
4FLO-P6G | data/4F/4FLO-P6G/4FLO-P6G_ligand.pdbqt | data/4F/4FLO-P6G/4FLO-P6G_target.pdbqt | data/4F/4FLO-P6G/4FLO-P6G_decoys.pdbqt | data/4F/4FLO-P6G/4FLO-P6G_decoy_scores.csv |
4FYH-TR5 | data/4F/4FYH-TR5/4FYH-TR5_ligand.pdbqt | data/4F/4FYH-TR5/4FYH-TR5_target.pdbqt | data/4F/4FYH-TR5/4FYH-TR5_decoys.pdbqt | data/4F/4FYH-TR5/4FYH-TR5_decoy_scores.csv |
4FV3-EK6 | data/4F/4FV3-EK6/4FV3-EK6_ligand.pdbqt | data/4F/4FV3-EK6/4FV3-EK6_target.pdbqt | data/4F/4FV3-EK6/4FV3-EK6_decoys.pdbqt | data/4F/4FV3-EK6/4FV3-EK6_decoy_scores.csv |
4FSU-HK5 | data/4F/4FSU-HK5/4FSU-HK5_ligand.pdbqt | data/4F/4FSU-HK5/4FSU-HK5_target.pdbqt | data/4F/4FSU-HK5/4FSU-HK5_decoys.pdbqt | data/4F/4FSU-HK5/4FSU-HK5_decoy_scores.csv |
4FVW-1KJ | data/4F/4FVW-1KJ/4FVW-1KJ_ligand.pdbqt | data/4F/4FVW-1KJ/4FVW-1KJ_target.pdbqt | data/4F/4FVW-1KJ/4FVW-1KJ_decoys.pdbqt | data/4F/4FVW-1KJ/4FVW-1KJ_decoy_scores.csv |
4FGC-PQ0 | data/4F/4FGC-PQ0/4FGC-PQ0_ligand.pdbqt | data/4F/4FGC-PQ0/4FGC-PQ0_target.pdbqt | data/4F/4FGC-PQ0/4FGC-PQ0_decoys.pdbqt | data/4F/4FGC-PQ0/4FGC-PQ0_decoy_scores.csv |
4FVO-0VV | data/4F/4FVO-0VV/4FVO-0VV_ligand.pdbqt | data/4F/4FVO-0VV/4FVO-0VV_target.pdbqt | data/4F/4FVO-0VV/4FVO-0VV_decoys.pdbqt | data/4F/4FVO-0VV/4FVO-0VV_decoy_scores.csv |
4F2O-QUS | data/4F/4F2O-QUS/4F2O-QUS_ligand.pdbqt | data/4F/4F2O-QUS/4F2O-QUS_target.pdbqt | data/4F/4F2O-QUS/4F2O-QUS_decoys.pdbqt | data/4F/4F2O-QUS/4F2O-QUS_decoy_scores.csv |
4FXS-IMP | data/4F/4FXS-IMP/4FXS-IMP_ligand.pdbqt | data/4F/4FXS-IMP/4FXS-IMP_target.pdbqt | data/4F/4FXS-IMP/4FXS-IMP_decoys.pdbqt | data/4F/4FXS-IMP/4FXS-IMP_decoy_scores.csv |
4FRQ-GAL | data/4F/4FRQ-GAL/4FRQ-GAL_ligand.pdbqt | data/4F/4FRQ-GAL/4FRQ-GAL_target.pdbqt | data/4F/4FRQ-GAL/4FRQ-GAL_decoys.pdbqt | data/4F/4FRQ-GAL/4FRQ-GAL_decoy_scores.csv |
4F8L-GAL | data/4F/4F8L-GAL/4F8L-GAL_ligand.pdbqt | data/4F/4F8L-GAL/4F8L-GAL_target.pdbqt | data/4F/4F8L-GAL/4F8L-GAL_decoys.pdbqt | data/4F/4F8L-GAL/4F8L-GAL_decoy_scores.csv |
4F21-0S1 | data/4F/4F21-0S1/4F21-0S1_ligand.pdbqt | data/4F/4F21-0S1/4F21-0S1_target.pdbqt | data/4F/4F21-0S1/4F21-0S1_decoys.pdbqt | data/4F/4F21-0S1/4F21-0S1_decoy_scores.csv |
4FR6-0V3 | data/4F/4FR6-0V3/4FR6-0V3_ligand.pdbqt | data/4F/4FR6-0V3/4FR6-0V3_target.pdbqt | data/4F/4FR6-0V3/4FR6-0V3_decoys.pdbqt | data/4F/4FR6-0V3/4FR6-0V3_decoy_scores.csv |
4FKX-CDP | data/4F/4FKX-CDP/4FKX-CDP_ligand.pdbqt | data/4F/4FKX-CDP/4FKX-CDP_target.pdbqt | data/4F/4FKX-CDP/4FKX-CDP_decoys.pdbqt | data/4F/4FKX-CDP/4FKX-CDP_decoy_scores.csv |
4FSQ-HK3 | data/4F/4FSQ-HK3/4FSQ-HK3_ligand.pdbqt | data/4F/4FSQ-HK3/4FSQ-HK3_target.pdbqt | data/4F/4FSQ-HK3/4FSQ-HK3_decoys.pdbqt | data/4F/4FSQ-HK3/4FSQ-HK3_decoy_scores.csv |
4FMQ-ANP | data/4F/4FMQ-ANP/4FMQ-ANP_ligand.pdbqt | data/4F/4FMQ-ANP/4FMQ-ANP_target.pdbqt | data/4F/4FMQ-ANP/4FMQ-ANP_decoys.pdbqt | data/4F/4FMQ-ANP/4FMQ-ANP_decoy_scores.csv |
4FVQ-ATP | data/4F/4FVQ-ATP/4FVQ-ATP_ligand.pdbqt | data/4F/4FVQ-ATP/4FVQ-ATP_target.pdbqt | data/4F/4FVQ-ATP/4FVQ-ATP_decoys.pdbqt | data/4F/4FVQ-ATP/4FVQ-ATP_decoy_scores.csv |
4FTJ-H8K | data/4F/4FTJ-H8K/4FTJ-H8K_ligand.pdbqt | data/4F/4FTJ-H8K/4FTJ-H8K_target.pdbqt | data/4F/4FTJ-H8K/4FTJ-H8K_decoys.pdbqt | data/4F/4FTJ-H8K/4FTJ-H8K_decoy_scores.csv |
4FTL-H0K | data/4F/4FTL-H0K/4FTL-H0K_ligand.pdbqt | data/4F/4FTL-H0K/4FTL-H0K_target.pdbqt | data/4F/4FTL-H0K/4FTL-H0K_decoys.pdbqt | data/4F/4FTL-H0K/4FTL-H0K_decoy_scores.csv |
4FFL-ADP | data/4F/4FFL-ADP/4FFL-ADP_ligand.pdbqt | data/4F/4FFL-ADP/4FFL-ADP_target.pdbqt | data/4F/4FFL-ADP/4FFL-ADP_decoys.pdbqt | data/4F/4FFL-ADP/4FFL-ADP_decoy_scores.csv |
4F46-DVN | data/4F/4F46-DVN/4F46-DVN_ligand.pdbqt | data/4F/4F46-DVN/4F46-DVN_target.pdbqt | data/4F/4F46-DVN/4F46-DVN_decoys.pdbqt | data/4F/4F46-DVN/4F46-DVN_decoy_scores.csv |
4FTK-H9K | data/4F/4FTK-H9K/4FTK-H9K_ligand.pdbqt | data/4F/4FTK-H9K/4FTK-H9K_target.pdbqt | data/4F/4FTK-H9K/4FTK-H9K_decoys.pdbqt | data/4F/4FTK-H9K/4FTK-H9K_decoy_scores.csv |
4FXS-MOA | data/4F/4FXS-MOA/4FXS-MOA_ligand.pdbqt | data/4F/4FXS-MOA/4FXS-MOA_target.pdbqt | data/4F/4FXS-MOA/4FXS-MOA_decoys.pdbqt | data/4F/4FXS-MOA/4FXS-MOA_decoy_scores.csv |
4FUT-ATP | data/4F/4FUT-ATP/4FUT-ATP_ligand.pdbqt | data/4F/4FUT-ATP/4FUT-ATP_target.pdbqt | data/4F/4FUT-ATP/4FUT-ATP_decoys.pdbqt | data/4F/4FUT-ATP/4FUT-ATP_decoy_scores.csv |
4FUL-0VU | data/4F/4FUL-0VU/4FUL-0VU_ligand.pdbqt | data/4F/4FUL-0VU/4FUL-0VU_target.pdbqt | data/4F/4FUL-0VU/4FUL-0VU_decoys.pdbqt | data/4F/4FUL-0VU/4FUL-0VU_decoy_scores.csv |
4FUD-6UP | data/4F/4FUD-6UP/4FUD-6UP_ligand.pdbqt | data/4F/4FUD-6UP/4FUD-6UP_target.pdbqt | data/4F/4FUD-6UP/4FUD-6UP_decoys.pdbqt | data/4F/4FUD-6UP/4FUD-6UP_decoy_scores.csv |
4FLG-GLU | data/4F/4FLG-GLU/4FLG-GLU_ligand.pdbqt | data/4F/4FLG-GLU/4FLG-GLU_target.pdbqt | data/4F/4FLG-GLU/4FLG-GLU_decoys.pdbqt | data/4F/4FLG-GLU/4FLG-GLU_decoy_scores.csv |
4FPK-IJ1 | data/4F/4FPK-IJ1/4FPK-IJ1_ligand.pdbqt | data/4F/4FPK-IJ1/4FPK-IJ1_target.pdbqt | data/4F/4FPK-IJ1/4FPK-IJ1_decoys.pdbqt | data/4F/4FPK-IJ1/4FPK-IJ1_decoy_scores.csv |
4FOZ-C8E | data/4F/4FOZ-C8E/4FOZ-C8E_ligand.pdbqt | data/4F/4FOZ-C8E/4FOZ-C8E_target.pdbqt | data/4F/4FOZ-C8E/4FOZ-C8E_decoys.pdbqt | data/4F/4FOZ-C8E/4FOZ-C8E_decoy_scores.csv |
4FT9-H4K | data/4F/4FT9-H4K/4FT9-H4K_ligand.pdbqt | data/4F/4FT9-H4K/4FT9-H4K_target.pdbqt | data/4F/4FT9-H4K/4FT9-H4K_decoys.pdbqt | data/4F/4FT9-H4K/4FT9-H4K_decoy_scores.csv |
4FT0-HK9 | data/4F/4FT0-HK9/4FT0-HK9_ligand.pdbqt | data/4F/4FT0-HK9/4FT0-HK9_target.pdbqt | data/4F/4FT0-HK9/4FT0-HK9_decoys.pdbqt | data/4F/4FT0-HK9/4FT0-HK9_decoy_scores.csv |
4FGH-0U6 | data/4F/4FGH-0U6/4FGH-0U6_ligand.pdbqt | data/4F/4FGH-0U6/4FGH-0U6_target.pdbqt | data/4F/4FGH-0U6/4FGH-0U6_decoys.pdbqt | data/4F/4FGH-0U6/4FGH-0U6_decoy_scores.csv |
4FBC-AMP | data/4F/4FBC-AMP/4FBC-AMP_ligand.pdbqt | data/4F/4FBC-AMP/4FBC-AMP_target.pdbqt | data/4F/4FBC-AMP/4FBC-AMP_decoys.pdbqt | data/4F/4FBC-AMP/4FBC-AMP_decoy_scores.csv |
4F4B-L39 | data/4F/4F4B-L39/4F4B-L39_ligand.pdbqt | data/4F/4F4B-L39/4F4B-L39_target.pdbqt | data/4F/4F4B-L39/4F4B-L39_decoys.pdbqt | data/4F/4F4B-L39/4F4B-L39_decoy_scores.csv |
4FGK-0TX | data/4F/4FGK-0TX/4FGK-0TX_ligand.pdbqt | data/4F/4FGK-0TX/4FGK-0TX_target.pdbqt | data/4F/4FGK-0TX/4FGK-0TX_decoys.pdbqt | data/4F/4FGK-0TX/4FGK-0TX_decoy_scores.csv |
4FFN-ANP | data/4F/4FFN-ANP/4FFN-ANP_ligand.pdbqt | data/4F/4FFN-ANP/4FFN-ANP_target.pdbqt | data/4F/4FFN-ANP/4FFN-ANP_decoys.pdbqt | data/4F/4FFN-ANP/4FFN-ANP_decoy_scores.csv |
4FA3-0SL | data/4F/4FA3-0SL/4FA3-0SL_ligand.pdbqt | data/4F/4FA3-0SL/4FA3-0SL_target.pdbqt | data/4F/4FA3-0SL/4FA3-0SL_decoys.pdbqt | data/4F/4FA3-0SL/4FA3-0SL_decoy_scores.csv |
4F9W-LM4 | data/4F/4F9W-LM4/4F9W-LM4_ligand.pdbqt | data/4F/4F9W-LM4/4F9W-LM4_target.pdbqt | data/4F/4F9W-LM4/4F9W-LM4_decoys.pdbqt | data/4F/4F9W-LM4/4F9W-LM4_decoy_scores.csv |
4FAT-496 | data/4F/4FAT-496/4FAT-496_ligand.pdbqt | data/4F/4FAT-496/4FAT-496_target.pdbqt | null | null |
4FAT-GLU | data/4F/4FAT-GLU/4FAT-GLU_ligand.pdbqt | data/4F/4FAT-GLU/4FAT-GLU_target.pdbqt | null | null |
4FAM-0SZ | data/4F/4FAM-0SZ/4FAM-0SZ_ligand.pdbqt | data/4F/4FAM-0SZ/4FAM-0SZ_target.pdbqt | data/4F/4FAM-0SZ/4FAM-0SZ_decoys.pdbqt | data/4F/4FAM-0SZ/4FAM-0SZ_decoy_scores.csv |
4FU9-675 | data/4F/4FU9-675/4FU9-675_ligand.pdbqt | data/4F/4FU9-675/4FU9-675_target.pdbqt | data/4F/4FU9-675/4FU9-675_decoys.pdbqt | data/4F/4FU9-675/4FU9-675_decoy_scores.csv |
4FVY-H4B | data/4F/4FVY-H4B/4FVY-H4B_ligand.pdbqt | data/4F/4FVY-H4B/4FVY-H4B_target.pdbqt | data/4F/4FVY-H4B/4FVY-H4B_decoys.pdbqt | data/4F/4FVY-H4B/4FVY-H4B_decoy_scores.csv |
4FZV-SAM | data/4F/4FZV-SAM/4FZV-SAM_ligand.pdbqt | data/4F/4FZV-SAM/4FZV-SAM_target.pdbqt | data/4F/4FZV-SAM/4FZV-SAM_decoys.pdbqt | data/4F/4FZV-SAM/4FZV-SAM_decoy_scores.csv |
4F7V-J1D | data/4F/4F7V-J1D/4F7V-J1D_ligand.pdbqt | data/4F/4F7V-J1D/4F7V-J1D_target.pdbqt | data/4F/4F7V-J1D/4F7V-J1D_decoys.pdbqt | data/4F/4F7V-J1D/4F7V-J1D_decoy_scores.csv |
4FV7-E94 | data/4F/4FV7-E94/4FV7-E94_ligand.pdbqt | data/4F/4FV7-E94/4FV7-E94_target.pdbqt | data/4F/4FV7-E94/4FV7-E94_decoys.pdbqt | data/4F/4FV7-E94/4FV7-E94_decoy_scores.csv |
4FUH-1U2 | data/4F/4FUH-1U2/4FUH-1U2_ligand.pdbqt | data/4F/4FUH-1U2/4FUH-1U2_target.pdbqt | data/4F/4FUH-1U2/4FUH-1U2_decoys.pdbqt | data/4F/4FUH-1U2/4FUH-1U2_decoy_scores.csv |
4F7I-MPO | data/4F/4F7I-MPO/4F7I-MPO_ligand.pdbqt | data/4F/4F7I-MPO/4F7I-MPO_target.pdbqt | data/4F/4F7I-MPO/4F7I-MPO_decoys.pdbqt | data/4F/4F7I-MPO/4F7I-MPO_decoy_scores.csv |
4FPC-MFY | data/4F/4FPC-MFY/4FPC-MFY_ligand.pdbqt | data/4F/4FPC-MFY/4FPC-MFY_target.pdbqt | data/4F/4FPC-MFY/4FPC-MFY_decoys.pdbqt | data/4F/4FPC-MFY/4FPC-MFY_decoy_scores.csv |
4F31-KAI | data/4F/4F31-KAI/4F31-KAI_ligand.pdbqt | data/4F/4F31-KAI/4F31-KAI_target.pdbqt | data/4F/4F31-KAI/4F31-KAI_decoys.pdbqt | data/4F/4F31-KAI/4F31-KAI_decoy_scores.csv |
4FIK-TH7 | data/4F/4FIK-TH7/4FIK-TH7_ligand.pdbqt | data/4F/4FIK-TH7/4FIK-TH7_target.pdbqt | data/4F/4FIK-TH7/4FIK-TH7_decoys.pdbqt | data/4F/4FIK-TH7/4FIK-TH7_decoy_scores.csv |
4FFM-ATP | data/4F/4FFM-ATP/4FFM-ATP_ligand.pdbqt | data/4F/4FFM-ATP/4FFM-ATP_target.pdbqt | data/4F/4FFM-ATP/4FFM-ATP_decoys.pdbqt | data/4F/4FFM-ATP/4FFM-ATP_decoy_scores.csv |
4FKV-61K | data/4F/4FKV-61K/4FKV-61K_ligand.pdbqt | data/4F/4FKV-61K/4FKV-61K_target.pdbqt | data/4F/4FKV-61K/4FKV-61K_decoys.pdbqt | data/4F/4FKV-61K/4FKV-61K_decoy_scores.csv |
4FSY-HK7 | data/4F/4FSY-HK7/4FSY-HK7_ligand.pdbqt | data/4F/4FSY-HK7/4FSY-HK7_target.pdbqt | data/4F/4FSY-HK7/4FSY-HK7_decoys.pdbqt | data/4F/4FSY-HK7/4FSY-HK7_decoy_scores.csv |
4FL3-ANP | data/4F/4FL3-ANP/4FL3-ANP_ligand.pdbqt | data/4F/4FL3-ANP/4FL3-ANP_target.pdbqt | data/4F/4FL3-ANP/4FL3-ANP_decoys.pdbqt | data/4F/4FL3-ANP/4FL3-ANP_decoy_scores.csv |
4FAK-SAM | data/4F/4FAK-SAM/4FAK-SAM_ligand.pdbqt | data/4F/4FAK-SAM/4FAK-SAM_target.pdbqt | data/4F/4FAK-SAM/4FAK-SAM_decoys.pdbqt | data/4F/4FAK-SAM/4FAK-SAM_decoy_scores.csv |
4FFL-LYS | data/4F/4FFL-LYS/4FFL-LYS_ligand.pdbqt | data/4F/4FFL-LYS/4FFL-LYS_target.pdbqt | data/4F/4FFL-LYS/4FFL-LYS_decoys.pdbqt | data/4F/4FFL-LYS/4FFL-LYS_decoy_scores.csv |
4FOI-BGC | data/4F/4FOI-BGC/4FOI-BGC_ligand.pdbqt | data/4F/4FOI-BGC/4FOI-BGC_target.pdbqt | data/4F/4FOI-BGC/4FOI-BGC_decoys.pdbqt | data/4F/4FOI-BGC/4FOI-BGC_decoy_scores.csv |
4FG8-ATP | data/4F/4FG8-ATP/4FG8-ATP_ligand.pdbqt | data/4F/4FG8-ATP/4FG8-ATP_target.pdbqt | data/4F/4FG8-ATP/4FG8-ATP_decoys.pdbqt | data/4F/4FG8-ATP/4FG8-ATP_decoy_scores.csv |
4FX8-BMP | data/4F/4FX8-BMP/4FX8-BMP_ligand.pdbqt | data/4F/4FX8-BMP/4FX8-BMP_target.pdbqt | data/4F/4FX8-BMP/4FX8-BMP_decoys.pdbqt | data/4F/4FX8-BMP/4FX8-BMP_decoy_scores.csv |
4FRL-GAL | data/4F/4FRL-GAL/4FRL-GAL_ligand.pdbqt | data/4F/4FRL-GAL/4FRL-GAL_target.pdbqt | data/4F/4FRL-GAL/4FRL-GAL_decoys.pdbqt | data/4F/4FRL-GAL/4FRL-GAL_decoy_scores.csv |
4FFS-BIG | data/4F/4FFS-BIG/4FFS-BIG_ligand.pdbqt | data/4F/4FFS-BIG/4FFS-BIG_target.pdbqt | data/4F/4FFS-BIG/4FFS-BIG_decoys.pdbqt | data/4F/4FFS-BIG/4FFS-BIG_decoy_scores.csv |
4F7U-P6G | data/4F/4F7U-P6G/4F7U-P6G_ligand.pdbqt | data/4F/4F7U-P6G/4F7U-P6G_target.pdbqt | data/4F/4F7U-P6G/4F7U-P6G_decoys.pdbqt | data/4F/4F7U-P6G/4F7U-P6G_decoy_scores.csv |
4FQ4-IJ4 | data/4F/4FQ4-IJ4/4FQ4-IJ4_ligand.pdbqt | data/4F/4FQ4-IJ4/4FQ4-IJ4_target.pdbqt | data/4F/4FQ4-IJ4/4FQ4-IJ4_decoys.pdbqt | data/4F/4FQ4-IJ4/4FQ4-IJ4_decoy_scores.csv |
4FCP-42C | data/4F/4FCP-42C/4FCP-42C_ligand.pdbqt | data/4F/4FCP-42C/4FCP-42C_target.pdbqt | data/4F/4FCP-42C/4FCP-42C_decoys.pdbqt | data/4F/4FCP-42C/4FCP-42C_decoy_scores.csv |
4F1O-ACP | data/4F/4F1O-ACP/4F1O-ACP_ligand.pdbqt | data/4F/4F1O-ACP/4F1O-ACP_target.pdbqt | data/4F/4F1O-ACP/4F1O-ACP_decoys.pdbqt | data/4F/4F1O-ACP/4F1O-ACP_decoy_scores.csv |
4FP1-BFM | data/4F/4FP1-BFM/4FP1-BFM_ligand.pdbqt | data/4F/4FP1-BFM/4FP1-BFM_target.pdbqt | data/4F/4FP1-BFM/4FP1-BFM_decoys.pdbqt | data/4F/4FP1-BFM/4FP1-BFM_decoy_scores.csv |
4FCF-MA4 | data/4F/4FCF-MA4/4FCF-MA4_ligand.pdbqt | data/4F/4FCF-MA4/4FCF-MA4_target.pdbqt | data/4F/4FCF-MA4/4FCF-MA4_decoys.pdbqt | data/4F/4FCF-MA4/4FCF-MA4_decoy_scores.csv |
4FHH-0U3 | data/4F/4FHH-0U3/4FHH-0U3_ligand.pdbqt | data/4F/4FHH-0U3/4FHH-0U3_target.pdbqt | data/4F/4FHH-0U3/4FHH-0U3_decoys.pdbqt | data/4F/4FHH-0U3/4FHH-0U3_decoy_scores.csv |
4FVZ-H4B | data/4F/4FVZ-H4B/4FVZ-H4B_ligand.pdbqt | data/4F/4FVZ-H4B/4FVZ-H4B_target.pdbqt | data/4F/4FVZ-H4B/4FVZ-H4B_decoys.pdbqt | data/4F/4FVZ-H4B/4FVZ-H4B_decoy_scores.csv |
4FSR-HKC | data/4F/4FSR-HKC/4FSR-HKC_ligand.pdbqt | data/4F/4FSR-HKC/4FSR-HKC_target.pdbqt | data/4F/4FSR-HKC/4FSR-HKC_decoys.pdbqt | data/4F/4FSR-HKC/4FSR-HKC_decoy_scores.csv |
4FEV-PP1 | data/4F/4FEV-PP1/4FEV-PP1_ligand.pdbqt | data/4F/4FEV-PP1/4FEV-PP1_target.pdbqt | data/4F/4FEV-PP1/4FEV-PP1_decoys.pdbqt | data/4F/4FEV-PP1/4FEV-PP1_decoy_scores.csv |
4FVY-3KJ | data/4F/4FVY-3KJ/4FVY-3KJ_ligand.pdbqt | data/4F/4FVY-3KJ/4FVY-3KJ_target.pdbqt | data/4F/4FVY-3KJ/4FVY-3KJ_decoys.pdbqt | data/4F/4FVY-3KJ/4FVY-3KJ_decoy_scores.csv |
4FKR-45K | data/4F/4FKR-45K/4FKR-45K_ligand.pdbqt | data/4F/4FKR-45K/4FKR-45K_target.pdbqt | data/4F/4FKR-45K/4FKR-45K_decoys.pdbqt | data/4F/4FKR-45K/4FKR-45K_decoy_scores.csv |
4F9M-FCM | data/4F/4F9M-FCM/4F9M-FCM_ligand.pdbqt | data/4F/4F9M-FCM/4F9M-FCM_target.pdbqt | data/4F/4F9M-FCM/4F9M-FCM_decoys.pdbqt | data/4F/4F9M-FCM/4F9M-FCM_decoy_scores.csv |
4FTU-7HK | data/4F/4FTU-7HK/4FTU-7HK_ligand.pdbqt | data/4F/4FTU-7HK/4FTU-7HK_target.pdbqt | data/4F/4FTU-7HK/4FTU-7HK_decoys.pdbqt | data/4F/4FTU-7HK/4FTU-7HK_decoy_scores.csv |
4FSW-HK6 | data/4F/4FSW-HK6/4FSW-HK6_ligand.pdbqt | data/4F/4FSW-HK6/4FSW-HK6_target.pdbqt | data/4F/4FSW-HK6/4FSW-HK6_decoys.pdbqt | data/4F/4FSW-HK6/4FSW-HK6_decoy_scores.csv |
4FF8-14S | data/4F/4FF8-14S/4FF8-14S_ligand.pdbqt | data/4F/4FF8-14S/4FF8-14S_target.pdbqt | data/4F/4FF8-14S/4FF8-14S_decoys.pdbqt | data/4F/4FF8-14S/4FF8-14S_decoy_scores.csv |
4FWG-SLA | data/4F/4FWG-SLA/4FWG-SLA_ligand.pdbqt | data/4F/4FWG-SLA/4FWG-SLA_target.pdbqt | data/4F/4FWG-SLA/4FWG-SLA_decoys.pdbqt | data/4F/4FWG-SLA/4FWG-SLA_decoy_scores.csv |
4FE6-0TQ | data/4F/4FE6-0TQ/4FE6-0TQ_ligand.pdbqt | data/4F/4FE6-0TQ/4FE6-0TQ_target.pdbqt | data/4F/4FE6-0TQ/4FE6-0TQ_decoys.pdbqt | data/4F/4FE6-0TQ/4FE6-0TQ_decoy_scores.csv |
4FGJ-1PQ | data/4F/4FGJ-1PQ/4FGJ-1PQ_ligand.pdbqt | data/4F/4FGJ-1PQ/4FGJ-1PQ_target.pdbqt | data/4F/4FGJ-1PQ/4FGJ-1PQ_decoys.pdbqt | data/4F/4FGJ-1PQ/4FGJ-1PQ_decoy_scores.csv |
4FH2-MA4 | data/4F/4FH2-MA4/4FH2-MA4_ligand.pdbqt | data/4F/4FH2-MA4/4FH2-MA4_target.pdbqt | data/4F/4FH2-MA4/4FH2-MA4_decoys.pdbqt | data/4F/4FH2-MA4/4FH2-MA4_decoy_scores.csv |
4FYV-DCP | data/4F/4FYV-DCP/4FYV-DCP_ligand.pdbqt | data/4F/4FYV-DCP/4FYV-DCP_target.pdbqt | data/4F/4FYV-DCP/4FYV-DCP_decoys.pdbqt | data/4F/4FYV-DCP/4FYV-DCP_decoy_scores.csv |
4FLI-Y16 | data/4F/4FLI-Y16/4FLI-Y16_ligand.pdbqt | data/4F/4FLI-Y16/4FLI-Y16_target.pdbqt | data/4F/4FLI-Y16/4FLI-Y16_decoys.pdbqt | data/4F/4FLI-Y16/4FLI-Y16_decoy_scores.csv |
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