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 ⌀ |
|---|---|---|---|---|
3NHK-VAP | data/3N/3NHK-VAP/3NHK-VAP_ligand.pdbqt | data/3N/3NHK-VAP/3NHK-VAP_target.pdbqt | data/3N/3NHK-VAP/3NHK-VAP_decoys.pdbqt | data/3N/3NHK-VAP/3NHK-VAP_decoy_scores.csv |
3NQG-BMP | data/3N/3NQG-BMP/3NQG-BMP_ligand.pdbqt | data/3N/3NQG-BMP/3NQG-BMP_target.pdbqt | data/3N/3NQG-BMP/3NQG-BMP_decoys.pdbqt | data/3N/3NQG-BMP/3NQG-BMP_decoy_scores.csv |
3NLG-H4B | data/3N/3NLG-H4B/3NLG-H4B_ligand.pdbqt | data/3N/3NLG-H4B/3NLG-H4B_target.pdbqt | null | null |
3NP9-Z2T | data/3N/3NP9-Z2T/3NP9-Z2T_ligand.pdbqt | data/3N/3NP9-Z2T/3NP9-Z2T_target.pdbqt | data/3N/3NP9-Z2T/3NP9-Z2T_decoys.pdbqt | data/3N/3NP9-Z2T/3NP9-Z2T_decoy_scores.csv |
3N6F-XFJ | data/3N/3N6F-XFJ/3N6F-XFJ_ligand.pdbqt | data/3N/3N6F-XFJ/3N6F-XFJ_target.pdbqt | null | null |
3N87-N87 | data/3N/3N87-N87/3N87-N87_ligand.pdbqt | data/3N/3N87-N87/3N87-N87_target.pdbqt | data/3N/3N87-N87/3N87-N87_decoys.pdbqt | data/3N/3N87-N87/3N87-N87_decoy_scores.csv |
3N8S-XD2 | data/3N/3N8S-XD2/3N8S-XD2_ligand.pdbqt | data/3N/3N8S-XD2/3N8S-XD2_target.pdbqt | data/3N/3N8S-XD2/3N8S-XD2_decoys.pdbqt | data/3N/3N8S-XD2/3N8S-XD2_decoy_scores.csv |
3NDE-9EP | data/3N/3NDE-9EP/3NDE-9EP_ligand.pdbqt | data/3N/3NDE-9EP/3NDE-9EP_target.pdbqt | data/3N/3NDE-9EP/3NDE-9EP_decoys.pdbqt | data/3N/3NDE-9EP/3NDE-9EP_decoy_scores.csv |
3N62-MTL | data/3N/3N62-MTL/3N62-MTL_ligand.pdbqt | data/3N/3N62-MTL/3N62-MTL_target.pdbqt | data/3N/3N62-MTL/3N62-MTL_decoys.pdbqt | data/3N/3N62-MTL/3N62-MTL_decoy_scores.csv |
3NA1-HCD | data/3N/3NA1-HCD/3NA1-HCD_ligand.pdbqt | data/3N/3NA1-HCD/3NA1-HCD_target.pdbqt | data/3N/3NA1-HCD/3NA1-HCD_decoys.pdbqt | data/3N/3NA1-HCD/3NA1-HCD_decoy_scores.csv |
3NBK-PNS | data/3N/3NBK-PNS/3NBK-PNS_ligand.pdbqt | data/3N/3NBK-PNS/3NBK-PNS_target.pdbqt | data/3N/3NBK-PNS/3NBK-PNS_decoys.pdbqt | data/3N/3NBK-PNS/3NBK-PNS_decoy_scores.csv |
3N0Y-APC | data/3N/3N0Y-APC/3N0Y-APC_ligand.pdbqt | data/3N/3N0Y-APC/3N0Y-APC_target.pdbqt | data/3N/3N0Y-APC/3N0Y-APC_decoys.pdbqt | data/3N/3N0Y-APC/3N0Y-APC_decoy_scores.csv |
3NMN-PYV | data/3N/3NMN-PYV/3NMN-PYV_ligand.pdbqt | data/3N/3NMN-PYV/3NMN-PYV_target.pdbqt | data/3N/3NMN-PYV/3NMN-PYV_decoys.pdbqt | data/3N/3NMN-PYV/3NMN-PYV_decoy_scores.csv |
3NU3-478 | data/3N/3NU3-478/3NU3-478_ligand.pdbqt | data/3N/3NU3-478/3NU3-478_target.pdbqt | data/3N/3NU3-478/3NU3-478_decoys.pdbqt | data/3N/3NU3-478/3NU3-478_decoy_scores.csv |
3N46-ZOL | data/3N/3N46-ZOL/3N46-ZOL_ligand.pdbqt | data/3N/3N46-ZOL/3N46-ZOL_target.pdbqt | data/3N/3N46-ZOL/3N46-ZOL_decoys.pdbqt | data/3N/3N46-ZOL/3N46-ZOL_decoy_scores.csv |
3NQD-BMP | data/3N/3NQD-BMP/3NQD-BMP_ligand.pdbqt | data/3N/3NQD-BMP/3NQD-BMP_target.pdbqt | data/3N/3NQD-BMP/3NQD-BMP_decoys.pdbqt | data/3N/3NQD-BMP/3NQD-BMP_decoy_scores.csv |
3NU9-478 | data/3N/3NU9-478/3NU9-478_ligand.pdbqt | data/3N/3NU9-478/3NU9-478_target.pdbqt | data/3N/3NU9-478/3NU9-478_decoys.pdbqt | data/3N/3NU9-478/3NU9-478_decoy_scores.csv |
3NFR-EWQ | data/3N/3NFR-EWQ/3NFR-EWQ_ligand.pdbqt | data/3N/3NFR-EWQ/3NFR-EWQ_target.pdbqt | data/3N/3NFR-EWQ/3NFR-EWQ_decoys.pdbqt | data/3N/3NFR-EWQ/3NFR-EWQ_decoy_scores.csv |
3NQS-H4B | data/3N/3NQS-H4B/3NQS-H4B_ligand.pdbqt | data/3N/3NQS-H4B/3NQS-H4B_target.pdbqt | data/3N/3NQS-H4B/3NQS-H4B_decoys.pdbqt | data/3N/3NQS-H4B/3NQS-H4B_decoy_scores.csv |
3N3M-NUP | data/3N/3N3M-NUP/3N3M-NUP_ligand.pdbqt | data/3N/3N3M-NUP/3N3M-NUP_target.pdbqt | data/3N/3N3M-NUP/3N3M-NUP_decoys.pdbqt | data/3N/3N3M-NUP/3N3M-NUP_decoy_scores.csv |
3NY6-V30 | data/3N/3NY6-V30/3NY6-V30_ligand.pdbqt | data/3N/3NY6-V30/3NY6-V30_target.pdbqt | data/3N/3NY6-V30/3NY6-V30_decoys.pdbqt | data/3N/3NY6-V30/3NY6-V30_decoy_scores.csv |
3NJO-PYV | data/3N/3NJO-PYV/3NJO-PYV_ligand.pdbqt | data/3N/3NJO-PYV/3NJO-PYV_target.pdbqt | data/3N/3NJO-PYV/3NJO-PYV_decoys.pdbqt | data/3N/3NJO-PYV/3NJO-PYV_decoy_scores.csv |
3NYQ-AMP | data/3N/3NYQ-AMP/3NYQ-AMP_ligand.pdbqt | data/3N/3NYQ-AMP/3NYQ-AMP_target.pdbqt | data/3N/3NYQ-AMP/3NYQ-AMP_decoys.pdbqt | data/3N/3NYQ-AMP/3NYQ-AMP_decoy_scores.csv |
3NLE-H4B | data/3N/3NLE-H4B/3NLE-H4B_ligand.pdbqt | data/3N/3NLE-H4B/3NLE-H4B_target.pdbqt | null | null |
3NW4-GTQ | data/3N/3NW4-GTQ/3NW4-GTQ_ligand.pdbqt | data/3N/3NW4-GTQ/3NW4-GTQ_target.pdbqt | data/3N/3NW4-GTQ/3NW4-GTQ_decoys.pdbqt | data/3N/3NW4-GTQ/3NW4-GTQ_decoy_scores.csv |
3NLP-JSS | data/3N/3NLP-JSS/3NLP-JSS_ligand.pdbqt | data/3N/3NLP-JSS/3NLP-JSS_target.pdbqt | data/3N/3NLP-JSS/3NLP-JSS_decoys.pdbqt | data/3N/3NLP-JSS/3NLP-JSS_decoy_scores.csv |
3NMV-PYV | data/3N/3NMV-PYV/3NMV-PYV_ligand.pdbqt | data/3N/3NMV-PYV/3NMV-PYV_target.pdbqt | data/3N/3NMV-PYV/3NMV-PYV_decoys.pdbqt | data/3N/3NMV-PYV/3NMV-PYV_decoy_scores.csv |
3N58-NAD | data/3N/3N58-NAD/3N58-NAD_ligand.pdbqt | data/3N/3N58-NAD/3N58-NAD_target.pdbqt | data/3N/3N58-NAD/3N58-NAD_decoys.pdbqt | data/3N/3N58-NAD/3N58-NAD_decoy_scores.csv |
3NYX-TZ1 | data/3N/3NYX-TZ1/3NYX-TZ1_ligand.pdbqt | data/3N/3NYX-TZ1/3NYX-TZ1_target.pdbqt | data/3N/3NYX-TZ1/3NYX-TZ1_decoys.pdbqt | data/3N/3NYX-TZ1/3NYX-TZ1_decoy_scores.csv |
3NXY-D2H | data/3N/3NXY-D2H/3NXY-D2H_ligand.pdbqt | data/3N/3NXY-D2H/3NXY-D2H_target.pdbqt | data/3N/3NXY-D2H/3NXY-D2H_decoys.pdbqt | data/3N/3NXY-D2H/3NXY-D2H_decoy_scores.csv |
3NOS-H4B | data/3N/3NOS-H4B/3NOS-H4B_ligand.pdbqt | data/3N/3NOS-H4B/3NOS-H4B_target.pdbqt | data/3N/3NOS-H4B/3NOS-H4B_decoys.pdbqt | data/3N/3NOS-H4B/3NOS-H4B_decoy_scores.csv |
3NAG-ADP | data/3N/3NAG-ADP/3NAG-ADP_ligand.pdbqt | data/3N/3NAG-ADP/3NAG-ADP_target.pdbqt | data/3N/3NAG-ADP/3NAG-ADP_decoys.pdbqt | data/3N/3NAG-ADP/3NAG-ADP_decoy_scores.csv |
3NVW-GUN | data/3N/3NVW-GUN/3NVW-GUN_ligand.pdbqt | data/3N/3NVW-GUN/3NVW-GUN_target.pdbqt | null | null |
3NG9-ADE | data/3N/3NG9-ADE/3NG9-ADE_ligand.pdbqt | data/3N/3NG9-ADE/3NG9-ADE_target.pdbqt | data/3N/3NG9-ADE/3NG9-ADE_decoys.pdbqt | data/3N/3NG9-ADE/3NG9-ADE_decoy_scores.csv |
3NHW-ZXZ | data/3N/3NHW-ZXZ/3NHW-ZXZ_ligand.pdbqt | data/3N/3NHW-ZXZ/3NHW-ZXZ_target.pdbqt | data/3N/3NHW-ZXZ/3NHW-ZXZ_decoys.pdbqt | data/3N/3NHW-ZXZ/3NHW-ZXZ_decoy_scores.csv |
3NP8-THP | data/3N/3NP8-THP/3NP8-THP_ligand.pdbqt | data/3N/3NP8-THP/3NP8-THP_target.pdbqt | data/3N/3NP8-THP/3NP8-THP_decoys.pdbqt | data/3N/3NP8-THP/3NP8-THP_decoy_scores.csv |
3N6E-H4B | data/3N/3N6E-H4B/3N6E-H4B_ligand.pdbqt | data/3N/3N6E-H4B/3N6E-H4B_target.pdbqt | null | null |
3NKV-AMP | data/3N/3NKV-AMP/3NKV-AMP_ligand.pdbqt | data/3N/3NKV-AMP/3NKV-AMP_target.pdbqt | null | null |
3N61-XFJ | data/3N/3N61-XFJ/3N61-XFJ_ligand.pdbqt | data/3N/3N61-XFJ/3N61-XFJ_target.pdbqt | data/3N/3N61-XFJ/3N61-XFJ_decoys.pdbqt | data/3N/3N61-XFJ/3N61-XFJ_decoy_scores.csv |
3NNZ-H4B | data/3N/3NNZ-H4B/3NNZ-H4B_ligand.pdbqt | data/3N/3NNZ-H4B/3NNZ-H4B_target.pdbqt | data/3N/3NNZ-H4B/3NNZ-H4B_decoys.pdbqt | data/3N/3NNZ-H4B/3NNZ-H4B_decoy_scores.csv |
3NIZ-ADP | data/3N/3NIZ-ADP/3NIZ-ADP_ligand.pdbqt | data/3N/3NIZ-ADP/3NIZ-ADP_target.pdbqt | data/3N/3NIZ-ADP/3NIZ-ADP_decoys.pdbqt | data/3N/3NIZ-ADP/3NIZ-ADP_decoy_scores.csv |
3N2M-FNU | data/3N/3N2M-FNU/3N2M-FNU_ligand.pdbqt | data/3N/3N2M-FNU/3N2M-FNU_target.pdbqt | data/3N/3N2M-FNU/3N2M-FNU_decoys.pdbqt | data/3N/3N2M-FNU/3N2M-FNU_decoy_scores.csv |
3N0H-TOP | data/3N/3N0H-TOP/3N0H-TOP_ligand.pdbqt | data/3N/3N0H-TOP/3N0H-TOP_target.pdbqt | data/3N/3N0H-TOP/3N0H-TOP_decoys.pdbqt | data/3N/3N0H-TOP/3N0H-TOP_decoy_scores.csv |
3NLO-JSR | data/3N/3NLO-JSR/3NLO-JSR_ligand.pdbqt | data/3N/3NLO-JSR/3NLO-JSR_target.pdbqt | data/3N/3NLO-JSR/3NLO-JSR_decoys.pdbqt | data/3N/3NLO-JSR/3NLO-JSR_decoy_scores.csv |
3NUO-478 | data/3N/3NUO-478/3NUO-478_ligand.pdbqt | data/3N/3NUO-478/3NUO-478_target.pdbqt | data/3N/3NUO-478/3NUO-478_decoys.pdbqt | data/3N/3NUO-478/3NUO-478_decoy_scores.csv |
3NLP-H4B | data/3N/3NLP-H4B/3NLP-H4B_ligand.pdbqt | data/3N/3NLP-H4B/3NLP-H4B_target.pdbqt | data/3N/3NLP-H4B/3NLP-H4B_decoys.pdbqt | data/3N/3NLP-H4B/3NLP-H4B_decoy_scores.csv |
3NLE-JRR | data/3N/3NLE-JRR/3NLE-JRR_ligand.pdbqt | data/3N/3NLE-JRR/3NLE-JRR_target.pdbqt | null | null |
3NSB-LI1 | data/3N/3NSB-LI1/3NSB-LI1_ligand.pdbqt | data/3N/3NSB-LI1/3NSB-LI1_target.pdbqt | data/3N/3NSB-LI1/3NSB-LI1_decoys.pdbqt | data/3N/3NSB-LI1/3NSB-LI1_decoy_scores.csv |
3NX7-NHK | data/3N/3NX7-NHK/3NX7-NHK_ligand.pdbqt | data/3N/3NX7-NHK/3NX7-NHK_target.pdbqt | data/3N/3NX7-NHK/3NX7-NHK_decoys.pdbqt | data/3N/3NX7-NHK/3NX7-NHK_decoy_scores.csv |
3N7A-FA1 | data/3N/3N7A-FA1/3N7A-FA1_ligand.pdbqt | data/3N/3N7A-FA1/3N7A-FA1_target.pdbqt | data/3N/3N7A-FA1/3N7A-FA1_decoys.pdbqt | data/3N/3N7A-FA1/3N7A-FA1_decoy_scores.csv |
3N65-MTL | data/3N/3N65-MTL/3N65-MTL_ligand.pdbqt | data/3N/3N65-MTL/3N65-MTL_target.pdbqt | data/3N/3N65-MTL/3N65-MTL_decoys.pdbqt | data/3N/3N65-MTL/3N65-MTL_decoy_scores.csv |
3N3A-FMN | data/3N/3N3A-FMN/3N3A-FMN_ligand.pdbqt | data/3N/3N3A-FMN/3N3A-FMN_target.pdbqt | data/3N/3N3A-FMN/3N3A-FMN_decoys.pdbqt | data/3N/3N3A-FMN/3N3A-FMN_decoy_scores.csv |
3N58-ADN | data/3N/3N58-ADN/3N58-ADN_ligand.pdbqt | data/3N/3N58-ADN/3N58-ADN_target.pdbqt | data/3N/3N58-ADN/3N58-ADN_decoys.pdbqt | data/3N/3N58-ADN/3N58-ADN_decoy_scores.csv |
3NHF-VVV | data/3N/3NHF-VVV/3NHF-VVV_ligand.pdbqt | data/3N/3NHF-VVV/3NHF-VVV_target.pdbqt | data/3N/3NHF-VVV/3NHF-VVV_decoys.pdbqt | data/3N/3NHF-VVV/3NHF-VVV_decoy_scores.csv |
3NBV-FRU | data/3N/3NBV-FRU/3NBV-FRU_ligand.pdbqt | data/3N/3NBV-FRU/3NBV-FRU_target.pdbqt | data/3N/3NBV-FRU/3NBV-FRU_decoys.pdbqt | data/3N/3NBV-FRU/3NBV-FRU_decoy_scores.csv |
3N9T-FLC | data/3N/3N9T-FLC/3N9T-FLC_ligand.pdbqt | data/3N/3N9T-FLC/3N9T-FLC_target.pdbqt | data/3N/3N9T-FLC/3N9T-FLC_decoys.pdbqt | data/3N/3N9T-FLC/3N9T-FLC_decoy_scores.csv |
3NUE-TRP | data/3N/3NUE-TRP/3NUE-TRP_ligand.pdbqt | data/3N/3NUE-TRP/3NUE-TRP_target.pdbqt | data/3N/3NUE-TRP/3NUE-TRP_decoys.pdbqt | data/3N/3NUE-TRP/3NUE-TRP_decoy_scores.csv |
3NW5-LGX | data/3N/3NW5-LGX/3NW5-LGX_ligand.pdbqt | data/3N/3NW5-LGX/3NW5-LGX_target.pdbqt | data/3N/3NW5-LGX/3NW5-LGX_decoys.pdbqt | data/3N/3NW5-LGX/3NW5-LGX_decoy_scores.csv |
3NVC-SAL | data/3N/3NVC-SAL/3NVC-SAL_ligand.pdbqt | data/3N/3NVC-SAL/3NVC-SAL_target.pdbqt | data/3N/3NVC-SAL/3NVC-SAL_decoys.pdbqt | data/3N/3NVC-SAL/3NVC-SAL_decoy_scores.csv |
3NEF-PYV | data/3N/3NEF-PYV/3NEF-PYV_ligand.pdbqt | data/3N/3NEF-PYV/3NEF-PYV_target.pdbqt | data/3N/3NEF-PYV/3NEF-PYV_decoys.pdbqt | data/3N/3NEF-PYV/3NEF-PYV_decoy_scores.csv |
3NVN-NDG | data/3N/3NVN-NDG/3NVN-NDG_ligand.pdbqt | data/3N/3NVN-NDG/3NVN-NDG_target.pdbqt | data/3N/3NVN-NDG/3NVN-NDG_decoys.pdbqt | data/3N/3NVN-NDG/3NVN-NDG_decoy_scores.csv |
3NLH-JSS | data/3N/3NLH-JSS/3NLH-JSS_ligand.pdbqt | data/3N/3NLH-JSS/3NLH-JSS_target.pdbqt | null | null |
3NXR-D2D | data/3N/3NXR-D2D/3NXR-D2D_ligand.pdbqt | data/3N/3NXR-D2D/3NXR-D2D_target.pdbqt | data/3N/3NXR-D2D/3NXR-D2D_decoys.pdbqt | data/3N/3NXR-D2D/3NXR-D2D_decoy_scores.csv |
3NOS-HAR | data/3N/3NOS-HAR/3NOS-HAR_ligand.pdbqt | data/3N/3NOS-HAR/3NOS-HAR_target.pdbqt | data/3N/3NOS-HAR/3NOS-HAR_decoys.pdbqt | data/3N/3NOS-HAR/3NOS-HAR_decoy_scores.csv |
3NC9-TR3 | data/3N/3NC9-TR3/3NC9-TR3_ligand.pdbqt | data/3N/3NC9-TR3/3NC9-TR3_target.pdbqt | data/3N/3NC9-TR3/3NC9-TR3_decoys.pdbqt | data/3N/3NC9-TR3/3NC9-TR3_decoy_scores.csv |
3N5Y-H4B | data/3N/3N5Y-H4B/3N5Y-H4B_ligand.pdbqt | data/3N/3N5Y-H4B/3N5Y-H4B_target.pdbqt | data/3N/3N5Y-H4B/3N5Y-H4B_decoys.pdbqt | data/3N/3N5Y-H4B/3N5Y-H4B_decoy_scores.csv |
3NB0-G6P | data/3N/3NB0-G6P/3NB0-G6P_ligand.pdbqt | data/3N/3NB0-G6P/3NB0-G6P_target.pdbqt | data/3N/3NB0-G6P/3NB0-G6P_decoys.pdbqt | data/3N/3NB0-G6P/3NB0-G6P_decoy_scores.csv |
3NVZ-MTE | data/3N/3NVZ-MTE/3NVZ-MTE_ligand.pdbqt | data/3N/3NVZ-MTE/3NVZ-MTE_target.pdbqt | null | null |
3NRR-D16 | data/3N/3NRR-D16/3NRR-D16_ligand.pdbqt | data/3N/3NRR-D16/3NRR-D16_target.pdbqt | data/3N/3NRR-D16/3NRR-D16_decoys.pdbqt | data/3N/3NRR-D16/3NRR-D16_decoy_scores.csv |
3N3G-935 | data/3N/3N3G-935/3N3G-935_ligand.pdbqt | data/3N/3N3G-935/3N3G-935_target.pdbqt | data/3N/3N3G-935/3N3G-935_decoys.pdbqt | data/3N/3N3G-935/3N3G-935_decoy_scores.csv |
3NNY-59R | data/3N/3NNY-59R/3NNY-59R_ligand.pdbqt | data/3N/3NNY-59R/3NNY-59R_target.pdbqt | data/3N/3NNY-59R/3NNY-59R_decoys.pdbqt | data/3N/3NNY-59R/3NNY-59R_decoy_scores.csv |
3NUA-ADP | data/3N/3NUA-ADP/3NUA-ADP_ligand.pdbqt | data/3N/3NUA-ADP/3NUA-ADP_target.pdbqt | data/3N/3NUA-ADP/3NUA-ADP_decoys.pdbqt | data/3N/3NUA-ADP/3NUA-ADP_decoy_scores.csv |
3NL1-GTQ | data/3N/3NL1-GTQ/3NL1-GTQ_ligand.pdbqt | data/3N/3NL1-GTQ/3NL1-GTQ_target.pdbqt | data/3N/3NL1-GTQ/3NL1-GTQ_decoys.pdbqt | data/3N/3NL1-GTQ/3NL1-GTQ_decoy_scores.csv |
3NGC-GP7 | data/3N/3NGC-GP7/3NGC-GP7_ligand.pdbqt | data/3N/3NGC-GP7/3NGC-GP7_target.pdbqt | data/3N/3NGC-GP7/3NGC-GP7_decoys.pdbqt | data/3N/3NGC-GP7/3NGC-GP7_decoy_scores.csv |
3NQF-BMP | data/3N/3NQF-BMP/3NQF-BMP_ligand.pdbqt | data/3N/3NQF-BMP/3NQF-BMP_target.pdbqt | data/3N/3NQF-BMP/3NQF-BMP_decoys.pdbqt | data/3N/3NQF-BMP/3NQF-BMP_decoy_scores.csv |
3NBV-ANP | data/3N/3NBV-ANP/3NBV-ANP_ligand.pdbqt | data/3N/3NBV-ANP/3NBV-ANP_target.pdbqt | data/3N/3NBV-ANP/3NBV-ANP_decoys.pdbqt | data/3N/3NBV-ANP/3NBV-ANP_decoy_scores.csv |
3N75-G4P | data/3N/3N75-G4P/3N75-G4P_ligand.pdbqt | data/3N/3N75-G4P/3N75-G4P_target.pdbqt | data/3N/3N75-G4P/3N75-G4P_decoys.pdbqt | data/3N/3N75-G4P/3N75-G4P_decoy_scores.csv |
3N6F-H4B | data/3N/3N6F-H4B/3N6F-H4B_ligand.pdbqt | data/3N/3N6F-H4B/3N6F-H4B_target.pdbqt | null | null |
3NYF-HHI | data/3N/3NYF-HHI/3NYF-HHI_ligand.pdbqt | data/3N/3NYF-HHI/3NYF-HHI_target.pdbqt | data/3N/3NYF-HHI/3NYF-HHI_decoys.pdbqt | data/3N/3NYF-HHI/3NYF-HHI_decoy_scores.csv |
3NLN-H4B | data/3N/3NLN-H4B/3NLN-H4B_ligand.pdbqt | data/3N/3NLN-H4B/3NLN-H4B_target.pdbqt | data/3N/3NLN-H4B/3NLN-H4B_decoys.pdbqt | data/3N/3NLN-H4B/3NLN-H4B_decoy_scores.csv |
3NHT-U46 | data/3N/3NHT-U46/3NHT-U46_ligand.pdbqt | data/3N/3NHT-U46/3NHT-U46_target.pdbqt | data/3N/3NHT-U46/3NHT-U46_decoys.pdbqt | data/3N/3NHT-U46/3NHT-U46_decoy_scores.csv |
3NZC-D2O | data/3N/3NZC-D2O/3NZC-D2O_ligand.pdbqt | data/3N/3NZC-D2O/3NZC-D2O_target.pdbqt | data/3N/3NZC-D2O/3NZC-D2O_decoys.pdbqt | data/3N/3NZC-D2O/3NZC-D2O_decoy_scores.csv |
3NPR-PS7 | data/3N/3NPR-PS7/3NPR-PS7_ligand.pdbqt | data/3N/3NPR-PS7/3NPR-PS7_target.pdbqt | data/3N/3NPR-PS7/3NPR-PS7_decoys.pdbqt | data/3N/3NPR-PS7/3NPR-PS7_decoy_scores.csv |
3NUE-CE1 | data/3N/3NUE-CE1/3NUE-CE1_ligand.pdbqt | data/3N/3NUE-CE1/3NUE-CE1_target.pdbqt | data/3N/3NUE-CE1/3NUE-CE1_decoys.pdbqt | data/3N/3NUE-CE1/3NUE-CE1_decoy_scores.csv |
3NLN-JRS | data/3N/3NLN-JRS/3NLN-JRS_ligand.pdbqt | data/3N/3NLN-JRS/3NLN-JRS_target.pdbqt | data/3N/3NLN-JRS/3NLN-JRS_decoys.pdbqt | data/3N/3NLN-JRS/3NLN-JRS_decoy_scores.csv |
3NTZ-3TZ | data/3N/3NTZ-3TZ/3NTZ-3TZ_ligand.pdbqt | data/3N/3NTZ-3TZ/3NTZ-3TZ_target.pdbqt | data/3N/3NTZ-3TZ/3NTZ-3TZ_decoys.pdbqt | data/3N/3NTZ-3TZ/3NTZ-3TZ_decoy_scores.csv |
3NJU-ANN | data/3N/3NJU-ANN/3NJU-ANN_ligand.pdbqt | data/3N/3NJU-ANN/3NJU-ANN_target.pdbqt | data/3N/3NJU-ANN/3NJU-ANN_decoys.pdbqt | data/3N/3NJU-ANN/3NJU-ANN_decoy_scores.csv |
3NZ4-TCA | data/3N/3NZ4-TCA/3NZ4-TCA_ligand.pdbqt | data/3N/3NZ4-TCA/3NZ4-TCA_target.pdbqt | data/3N/3NZ4-TCA/3NZ4-TCA_decoys.pdbqt | data/3N/3NZ4-TCA/3NZ4-TCA_decoy_scores.csv |
3N2Y-TEF | data/3N/3N2Y-TEF/3N2Y-TEF_ligand.pdbqt | data/3N/3N2Y-TEF/3N2Y-TEF_target.pdbqt | data/3N/3N2Y-TEF/3N2Y-TEF_decoys.pdbqt | data/3N/3N2Y-TEF/3N2Y-TEF_decoy_scores.csv |
3NM0-3XE | data/3N/3NM0-3XE/3NM0-3XE_ligand.pdbqt | data/3N/3NM0-3XE/3NM0-3XE_target.pdbqt | data/3N/3NM0-3XE/3NM0-3XE_decoys.pdbqt | data/3N/3NM0-3XE/3NM0-3XE_decoy_scores.csv |
3NRC-TCL | data/3N/3NRC-TCL/3NRC-TCL_ligand.pdbqt | data/3N/3NRC-TCL/3NRC-TCL_target.pdbqt | data/3N/3NRC-TCL/3NRC-TCL_decoys.pdbqt | data/3N/3NRC-TCL/3NRC-TCL_decoy_scores.csv |
3NLZ-3XD | data/3N/3NLZ-3XD/3NLZ-3XD_ligand.pdbqt | data/3N/3NLZ-3XD/3NLZ-3XD_target.pdbqt | data/3N/3NLZ-3XD/3NLZ-3XD_decoys.pdbqt | data/3N/3NLZ-3XD/3NLZ-3XD_decoy_scores.csv |
3NLH-H4B | data/3N/3NLH-H4B/3NLH-H4B_ligand.pdbqt | data/3N/3NLH-H4B/3NLH-H4B_target.pdbqt | null | null |
3NXX-D2D | data/3N/3NXX-D2D/3NXX-D2D_ligand.pdbqt | data/3N/3NXX-D2D/3NXX-D2D_target.pdbqt | data/3N/3NXX-D2D/3NXX-D2D_decoys.pdbqt | data/3N/3NXX-D2D/3NXX-D2D_decoy_scores.csv |
3NRZ-HPA | data/3N/3NRZ-HPA/3NRZ-HPA_ligand.pdbqt | data/3N/3NRZ-HPA/3NRZ-HPA_target.pdbqt | null | null |
3N0B-UMP | data/3N/3N0B-UMP/3N0B-UMP_ligand.pdbqt | data/3N/3N0B-UMP/3N0B-UMP_target.pdbqt | data/3N/3N0B-UMP/3N0B-UMP_decoys.pdbqt | data/3N/3N0B-UMP/3N0B-UMP_decoy_scores.csv |
3N6I-XD1 | data/3N/3N6I-XD1/3N6I-XD1_ligand.pdbqt | data/3N/3N6I-XD1/3N6I-XD1_target.pdbqt | data/3N/3N6I-XD1/3N6I-XD1_decoys.pdbqt | data/3N/3N6I-XD1/3N6I-XD1_decoy_scores.csv |
3N7H-DE3 | data/3N/3N7H-DE3/3N7H-DE3_ligand.pdbqt | data/3N/3N7H-DE3/3N7H-DE3_target.pdbqt | data/3N/3N7H-DE3/3N7H-DE3_decoys.pdbqt | data/3N/3N7H-DE3/3N7H-DE3_decoy_scores.csv |
3NQ6-UP6 | data/3N/3NQ6-UP6/3NQ6-UP6_ligand.pdbqt | data/3N/3NQ6-UP6/3NQ6-UP6_target.pdbqt | data/3N/3NQ6-UP6/3NQ6-UP6_decoys.pdbqt | data/3N/3NQ6-UP6/3NQ6-UP6_decoy_scores.csv |
3NXO-D2B | data/3N/3NXO-D2B/3NXO-D2B_ligand.pdbqt | data/3N/3NXO-D2B/3NXO-D2B_target.pdbqt | data/3N/3NXO-D2B/3NXO-D2B_decoys.pdbqt | data/3N/3NXO-D2B/3NXO-D2B_decoy_scores.csv |
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