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 ⌀ |
|---|---|---|---|---|
3FCQ-M3S | data/3F/3FCQ-M3S/3FCQ-M3S_ligand.pdbqt | data/3F/3FCQ-M3S/3FCQ-M3S_target.pdbqt | data/3F/3FCQ-M3S/3FCQ-M3S_decoys.pdbqt | data/3F/3FCQ-M3S/3FCQ-M3S_decoy_scores.csv |
3F5G-ADP | data/3F/3F5G-ADP/3F5G-ADP_ligand.pdbqt | data/3F/3F5G-ADP/3F5G-ADP_target.pdbqt | data/3F/3F5G-ADP/3F5G-ADP_decoys.pdbqt | data/3F/3F5G-ADP/3F5G-ADP_decoy_scores.csv |
3FQ8-PMP | data/3F/3FQ8-PMP/3FQ8-PMP_ligand.pdbqt | data/3F/3FQ8-PMP/3FQ8-PMP_target.pdbqt | data/3F/3FQ8-PMP/3FQ8-PMP_decoys.pdbqt | data/3F/3FQ8-PMP/3FQ8-PMP_decoy_scores.csv |
3FUL-52D | data/3F/3FUL-52D/3FUL-52D_ligand.pdbqt | data/3F/3FUL-52D/3FUL-52D_target.pdbqt | null | null |
3F9N-38M | data/3F/3F9N-38M/3F9N-38M_ligand.pdbqt | data/3F/3F9N-38M/3F9N-38M_target.pdbqt | data/3F/3F9N-38M/3F9N-38M_decoys.pdbqt | data/3F/3F9N-38M/3F9N-38M_decoy_scores.csv |
3FBE-GDP | data/3F/3FBE-GDP/3FBE-GDP_ligand.pdbqt | data/3F/3FBE-GDP/3FBE-GDP_target.pdbqt | data/3F/3FBE-GDP/3FBE-GDP_decoys.pdbqt | data/3F/3FBE-GDP/3FBE-GDP_decoy_scores.csv |
3FB1-R1P | data/3F/3FB1-R1P/3FB1-R1P_ligand.pdbqt | data/3F/3FB1-R1P/3FB1-R1P_target.pdbqt | data/3F/3FB1-R1P/3FB1-R1P_decoys.pdbqt | data/3F/3FB1-R1P/3FB1-R1P_decoy_scores.csv |
3FYS-PLM | data/3F/3FYS-PLM/3FYS-PLM_ligand.pdbqt | data/3F/3FYS-PLM/3FYS-PLM_target.pdbqt | data/3F/3FYS-PLM/3FYS-PLM_decoys.pdbqt | data/3F/3FYS-PLM/3FYS-PLM_decoy_scores.csv |
3FEG-HC7 | data/3F/3FEG-HC7/3FEG-HC7_ligand.pdbqt | data/3F/3FEG-HC7/3FEG-HC7_target.pdbqt | data/3F/3FEG-HC7/3FEG-HC7_decoys.pdbqt | data/3F/3FEG-HC7/3FEG-HC7_decoy_scores.csv |
3FS6-DH1 | data/3F/3FS6-DH1/3FS6-DH1_ligand.pdbqt | data/3F/3FS6-DH1/3FS6-DH1_target.pdbqt | data/3F/3FS6-DH1/3FS6-DH1_decoys.pdbqt | data/3F/3FS6-DH1/3FS6-DH1_decoy_scores.csv |
3FNQ-HPA | data/3F/3FNQ-HPA/3FNQ-HPA_ligand.pdbqt | data/3F/3FNQ-HPA/3FNQ-HPA_target.pdbqt | data/3F/3FNQ-HPA/3FNQ-HPA_decoys.pdbqt | data/3F/3FNQ-HPA/3FNQ-HPA_decoy_scores.csv |
3FZN-D7K | data/3F/3FZN-D7K/3FZN-D7K_ligand.pdbqt | data/3F/3FZN-D7K/3FZN-D7K_target.pdbqt | data/3F/3FZN-D7K/3FZN-D7K_decoys.pdbqt | data/3F/3FZN-D7K/3FZN-D7K_decoy_scores.csv |
3FJ4-MUC | data/3F/3FJ4-MUC/3FJ4-MUC_ligand.pdbqt | data/3F/3FJ4-MUC/3FJ4-MUC_target.pdbqt | data/3F/3FJ4-MUC/3FJ4-MUC_decoys.pdbqt | data/3F/3FJ4-MUC/3FJ4-MUC_decoy_scores.csv |
3FW1-STI | data/3F/3FW1-STI/3FW1-STI_ligand.pdbqt | data/3F/3FW1-STI/3FW1-STI_target.pdbqt | data/3F/3FW1-STI/3FW1-STI_decoys.pdbqt | data/3F/3FW1-STI/3FW1-STI_decoy_scores.csv |
3FU5-492 | data/3F/3FU5-492/3FU5-492_ligand.pdbqt | data/3F/3FU5-492/3FU5-492_target.pdbqt | null | null |
3FPJ-SAM | data/3F/3FPJ-SAM/3FPJ-SAM_ligand.pdbqt | data/3F/3FPJ-SAM/3FPJ-SAM_target.pdbqt | data/3F/3FPJ-SAM/3FPJ-SAM_decoys.pdbqt | data/3F/3FPJ-SAM/3FPJ-SAM_decoy_scores.csv |
3F6X-IHH | data/3F/3F6X-IHH/3F6X-IHH_ligand.pdbqt | data/3F/3F6X-IHH/3F6X-IHH_target.pdbqt | data/3F/3F6X-IHH/3F6X-IHH_decoys.pdbqt | data/3F/3F6X-IHH/3F6X-IHH_decoy_scores.csv |
3F16-HS3 | data/3F/3F16-HS3/3F16-HS3_ligand.pdbqt | data/3F/3F16-HS3/3F16-HS3_target.pdbqt | data/3F/3F16-HS3/3F16-HS3_decoys.pdbqt | data/3F/3F16-HS3/3F16-HS3_decoy_scores.csv |
3FE1-ADP | data/3F/3FE1-ADP/3FE1-ADP_ligand.pdbqt | data/3F/3FE1-ADP/3FE1-ADP_target.pdbqt | data/3F/3FE1-ADP/3FE1-ADP_decoys.pdbqt | data/3F/3FE1-ADP/3FE1-ADP_decoy_scores.csv |
3FUC-9D9 | data/3F/3FUC-9D9/3FUC-9D9_ligand.pdbqt | data/3F/3FUC-9D9/3FUC-9D9_target.pdbqt | data/3F/3FUC-9D9/3FUC-9D9_decoys.pdbqt | data/3F/3FUC-9D9/3FUC-9D9_decoy_scores.csv |
3F9X-SAH | data/3F/3F9X-SAH/3F9X-SAH_ligand.pdbqt | data/3F/3F9X-SAH/3F9X-SAH_target.pdbqt | data/3F/3F9X-SAH/3F9X-SAH_decoys.pdbqt | data/3F/3F9X-SAH/3F9X-SAH_decoy_scores.csv |
3F5O-P6G | data/3F/3F5O-P6G/3F5O-P6G_ligand.pdbqt | data/3F/3F5O-P6G/3F5O-P6G_target.pdbqt | data/3F/3F5O-P6G/3F5O-P6G_decoys.pdbqt | data/3F/3F5O-P6G/3F5O-P6G_decoy_scores.csv |
3FRH-SAH | data/3F/3FRH-SAH/3FRH-SAH_ligand.pdbqt | data/3F/3FRH-SAH/3FRH-SAH_target.pdbqt | data/3F/3FRH-SAH/3FRH-SAH_decoys.pdbqt | data/3F/3FRH-SAH/3FRH-SAH_decoy_scores.csv |
3FID-CXE | data/3F/3FID-CXE/3FID-CXE_ligand.pdbqt | data/3F/3FID-CXE/3FID-CXE_target.pdbqt | data/3F/3FID-CXE/3FID-CXE_decoys.pdbqt | data/3F/3FID-CXE/3FID-CXE_decoy_scores.csv |
3FWN-6PG | data/3F/3FWN-6PG/3FWN-6PG_ligand.pdbqt | data/3F/3FWN-6PG/3FWN-6PG_target.pdbqt | data/3F/3FWN-6PG/3FWN-6PG_decoys.pdbqt | data/3F/3FWN-6PG/3FWN-6PG_decoy_scores.csv |
3FJO-FMN | data/3F/3FJO-FMN/3FJO-FMN_ligand.pdbqt | data/3F/3FJO-FMN/3FJO-FMN_target.pdbqt | data/3F/3FJO-FMN/3FJO-FMN_decoys.pdbqt | data/3F/3FJO-FMN/3FJO-FMN_decoy_scores.csv |
3F80-6HN | data/3F/3F80-6HN/3F80-6HN_ligand.pdbqt | data/3F/3F80-6HN/3F80-6HN_target.pdbqt | data/3F/3F80-6HN/3F80-6HN_decoys.pdbqt | data/3F/3F80-6HN/3F80-6HN_decoy_scores.csv |
3FTX-RE2 | data/3F/3FTX-RE2/3FTX-RE2_ligand.pdbqt | data/3F/3FTX-RE2/3FTX-RE2_target.pdbqt | null | null |
3FR2-8CA | data/3F/3FR2-8CA/3FR2-8CA_ligand.pdbqt | data/3F/3FR2-8CA/3FR2-8CA_target.pdbqt | data/3F/3FR2-8CA/3FR2-8CA_decoys.pdbqt | data/3F/3FR2-8CA/3FR2-8CA_decoy_scores.csv |
3F78-ICF | data/3F/3F78-ICF/3F78-ICF_ligand.pdbqt | data/3F/3F78-ICF/3F78-ICF_target.pdbqt | data/3F/3F78-ICF/3F78-ICF_decoys.pdbqt | data/3F/3F78-ICF/3F78-ICF_decoy_scores.csv |
3F97-GD7 | data/3F/3F97-GD7/3F97-GD7_ligand.pdbqt | data/3F/3F97-GD7/3F97-GD7_target.pdbqt | data/3F/3F97-GD7/3F97-GD7_decoys.pdbqt | data/3F/3F97-GD7/3F97-GD7_decoy_scores.csv |
3FSF-FSS | data/3F/3FSF-FSS/3FSF-FSS_ligand.pdbqt | data/3F/3FSF-FSS/3FSF-FSS_target.pdbqt | data/3F/3FSF-FSS/3FSF-FSS_decoys.pdbqt | data/3F/3FSF-FSS/3FSF-FSS_decoy_scores.csv |
3FPD-Q4A | data/3F/3FPD-Q4A/3FPD-Q4A_ligand.pdbqt | data/3F/3FPD-Q4A/3FPD-Q4A_target.pdbqt | data/3F/3FPD-Q4A/3FPD-Q4A_decoys.pdbqt | data/3F/3FPD-Q4A/3FPD-Q4A_decoy_scores.csv |
3F9W-SAH | data/3F/3F9W-SAH/3F9W-SAH_ligand.pdbqt | data/3F/3F9W-SAH/3F9W-SAH_target.pdbqt | data/3F/3F9W-SAH/3F9W-SAH_decoys.pdbqt | data/3F/3F9W-SAH/3F9W-SAH_decoy_scores.csv |
3F5X-EZV | data/3F/3F5X-EZV/3F5X-EZV_ligand.pdbqt | data/3F/3F5X-EZV/3F5X-EZV_target.pdbqt | data/3F/3F5X-EZV/3F5X-EZV_decoys.pdbqt | data/3F/3F5X-EZV/3F5X-EZV_decoy_scores.csv |
3F46-I2C | data/3F/3F46-I2C/3F46-I2C_ligand.pdbqt | data/3F/3F46-I2C/3F46-I2C_target.pdbqt | data/3F/3F46-I2C/3F46-I2C_decoys.pdbqt | data/3F/3F46-I2C/3F46-I2C_decoy_scores.csv |
3F28-S7B | data/3F/3F28-S7B/3F28-S7B_ligand.pdbqt | data/3F/3F28-S7B/3F28-S7B_target.pdbqt | data/3F/3F28-S7B/3F28-S7B_decoys.pdbqt | data/3F/3F28-S7B/3F28-S7B_decoy_scores.csv |
3FUX-MTA | data/3F/3FUX-MTA/3FUX-MTA_ligand.pdbqt | data/3F/3FUX-MTA/3FUX-MTA_target.pdbqt | data/3F/3FUX-MTA/3FUX-MTA_decoys.pdbqt | data/3F/3FUX-MTA/3FUX-MTA_decoy_scores.csv |
3FT5-MO8 | data/3F/3FT5-MO8/3FT5-MO8_ligand.pdbqt | data/3F/3FT5-MO8/3FT5-MO8_target.pdbqt | data/3F/3FT5-MO8/3FT5-MO8_decoys.pdbqt | data/3F/3FT5-MO8/3FT5-MO8_decoy_scores.csv |
3FY9-XCF | data/3F/3FY9-XCF/3FY9-XCF_ligand.pdbqt | data/3F/3FY9-XCF/3FY9-XCF_target.pdbqt | data/3F/3FY9-XCF/3FY9-XCF_decoys.pdbqt | data/3F/3FY9-XCF/3FY9-XCF_decoy_scores.csv |
3F66-IHX | data/3F/3F66-IHX/3F66-IHX_ligand.pdbqt | data/3F/3F66-IHX/3F66-IHX_target.pdbqt | data/3F/3F66-IHX/3F66-IHX_decoys.pdbqt | data/3F/3F66-IHX/3F66-IHX_decoy_scores.csv |
3FUZ-GLU | data/3F/3FUZ-GLU/3FUZ-GLU_ligand.pdbqt | data/3F/3FUZ-GLU/3FUZ-GLU_target.pdbqt | data/3F/3FUZ-GLU/3FUZ-GLU_decoys.pdbqt | data/3F/3FUZ-GLU/3FUZ-GLU_decoy_scores.csv |
3FFP-LC1 | data/3F/3FFP-LC1/3FFP-LC1_ligand.pdbqt | data/3F/3FFP-LC1/3FFP-LC1_target.pdbqt | data/3F/3FFP-LC1/3FFP-LC1_decoys.pdbqt | data/3F/3FFP-LC1/3FFP-LC1_decoy_scores.csv |
3FGD-BYA | data/3F/3FGD-BYA/3FGD-BYA_ligand.pdbqt | data/3F/3FGD-BYA/3FGD-BYA_target.pdbqt | data/3F/3FGD-BYA/3FGD-BYA_decoys.pdbqt | data/3F/3FGD-BYA/3FGD-BYA_decoy_scores.csv |
3FQC-55V | data/3F/3FQC-55V/3FQC-55V_ligand.pdbqt | data/3F/3FQC-55V/3FQC-55V_target.pdbqt | data/3F/3FQC-55V/3FQC-55V_decoys.pdbqt | data/3F/3FQC-55V/3FQC-55V_decoy_scores.csv |
3FYH-ADP | data/3F/3FYH-ADP/3FYH-ADP_ligand.pdbqt | data/3F/3FYH-ADP/3FYH-ADP_target.pdbqt | data/3F/3FYH-ADP/3FYH-ADP_decoys.pdbqt | data/3F/3FYH-ADP/3FYH-ADP_decoy_scores.csv |
3FLQ-891 | data/3F/3FLQ-891/3FLQ-891_ligand.pdbqt | data/3F/3FLQ-891/3FLQ-891_target.pdbqt | data/3F/3FLQ-891/3FLQ-891_decoys.pdbqt | data/3F/3FLQ-891/3FLQ-891_decoy_scores.csv |
3FUI-812 | data/3F/3FUI-812/3FUI-812_ligand.pdbqt | data/3F/3FUI-812/3FUI-812_target.pdbqt | null | null |
3FCC-ATP | data/3F/3FCC-ATP/3FCC-ATP_ligand.pdbqt | data/3F/3FCC-ATP/3FCC-ATP_target.pdbqt | data/3F/3FCC-ATP/3FCC-ATP_decoys.pdbqt | data/3F/3FCC-ATP/3FCC-ATP_decoy_scores.csv |
3FF5-DPW | data/3F/3FF5-DPW/3FF5-DPW_ligand.pdbqt | data/3F/3FF5-DPW/3FF5-DPW_target.pdbqt | data/3F/3FF5-DPW/3FF5-DPW_decoys.pdbqt | data/3F/3FF5-DPW/3FF5-DPW_decoy_scores.csv |
3FR3-GDS | data/3F/3FR3-GDS/3FR3-GDS_ligand.pdbqt | data/3F/3FR3-GDS/3FR3-GDS_target.pdbqt | data/3F/3FR3-GDS/3FR3-GDS_decoys.pdbqt | data/3F/3FR3-GDS/3FR3-GDS_decoy_scores.csv |
3F4B-TCL | data/3F/3F4B-TCL/3F4B-TCL_ligand.pdbqt | data/3F/3F4B-TCL/3F4B-TCL_target.pdbqt | data/3F/3F4B-TCL/3F4B-TCL_decoys.pdbqt | data/3F/3F4B-TCL/3F4B-TCL_decoy_scores.csv |
3FTZ-848 | data/3F/3FTZ-848/3FTZ-848_ligand.pdbqt | data/3F/3FTZ-848/3FTZ-848_target.pdbqt | null | null |
3FYW-XCF | data/3F/3FYW-XCF/3FYW-XCF_ligand.pdbqt | data/3F/3FYW-XCF/3FYW-XCF_target.pdbqt | data/3F/3FYW-XCF/3FYW-XCF_decoys.pdbqt | data/3F/3FYW-XCF/3FYW-XCF_decoy_scores.csv |
3FVL-BHK | data/3F/3FVL-BHK/3FVL-BHK_ligand.pdbqt | data/3F/3FVL-BHK/3FVL-BHK_target.pdbqt | data/3F/3FVL-BHK/3FVL-BHK_decoys.pdbqt | data/3F/3FVL-BHK/3FVL-BHK_decoy_scores.csv |
3FQA-PMP | data/3F/3FQA-PMP/3FQA-PMP_ligand.pdbqt | data/3F/3FQA-PMP/3FQA-PMP_target.pdbqt | data/3F/3FQA-PMP/3FQA-PMP_decoys.pdbqt | data/3F/3FQA-PMP/3FQA-PMP_decoy_scores.csv |
3F7H-BTB | data/3F/3F7H-BTB/3F7H-BTB_ligand.pdbqt | data/3F/3F7H-BTB/3F7H-BTB_target.pdbqt | null | null |
3FYI-TRD | data/3F/3FYI-TRD/3FYI-TRD_ligand.pdbqt | data/3F/3FYI-TRD/3FYI-TRD_target.pdbqt | data/3F/3FYI-TRD/3FYI-TRD_decoys.pdbqt | data/3F/3FYI-TRD/3FYI-TRD_decoy_scores.csv |
3FL5-TXQ | data/3F/3FL5-TXQ/3FL5-TXQ_ligand.pdbqt | data/3F/3FL5-TXQ/3FL5-TXQ_target.pdbqt | data/3F/3FL5-TXQ/3FL5-TXQ_decoys.pdbqt | data/3F/3FL5-TXQ/3FL5-TXQ_decoy_scores.csv |
3FU3-92G | data/3F/3FU3-92G/3FU3-92G_ligand.pdbqt | data/3F/3FU3-92G/3FU3-92G_target.pdbqt | null | null |
3FUH-BES | data/3F/3FUH-BES/3FUH-BES_ligand.pdbqt | data/3F/3FUH-BES/3FUH-BES_target.pdbqt | null | null |
3FSC-T3F | data/3F/3FSC-T3F/3FSC-T3F_ligand.pdbqt | data/3F/3FSC-T3F/3FSC-T3F_target.pdbqt | data/3F/3FSC-T3F/3FSC-T3F_decoys.pdbqt | data/3F/3FSC-T3F/3FSC-T3F_decoy_scores.csv |
3FCI-3FI | data/3F/3FCI-3FI/3FCI-3FI_ligand.pdbqt | data/3F/3FCI-3FI/3FCI-3FI_target.pdbqt | data/3F/3FCI-3FI/3FCI-3FI_decoys.pdbqt | data/3F/3FCI-3FI/3FCI-3FI_decoy_scores.csv |
3FXM-FLC | data/3F/3FXM-FLC/3FXM-FLC_ligand.pdbqt | data/3F/3FXM-FLC/3FXM-FLC_target.pdbqt | data/3F/3FXM-FLC/3FXM-FLC_decoys.pdbqt | data/3F/3FXM-FLC/3FXM-FLC_decoy_scores.csv |
3FAS-GLU | data/3F/3FAS-GLU/3FAS-GLU_ligand.pdbqt | data/3F/3FAS-GLU/3FAS-GLU_target.pdbqt | data/3F/3FAS-GLU/3FAS-GLU_decoys.pdbqt | data/3F/3FAS-GLU/3FAS-GLU_decoy_scores.csv |
3FI2-JK1 | data/3F/3FI2-JK1/3FI2-JK1_ligand.pdbqt | data/3F/3FI2-JK1/3FI2-JK1_target.pdbqt | data/3F/3FI2-JK1/3FI2-JK1_decoys.pdbqt | data/3F/3FI2-JK1/3FI2-JK1_decoy_scores.csv |
3FKB-TNV | data/3F/3FKB-TNV/3FKB-TNV_ligand.pdbqt | data/3F/3FKB-TNV/3FKB-TNV_target.pdbqt | data/3F/3FKB-TNV/3FKB-TNV_decoys.pdbqt | data/3F/3FKB-TNV/3FKB-TNV_decoy_scores.csv |
3FYE-HTO | data/3F/3FYE-HTO/3FYE-HTO_ligand.pdbqt | data/3F/3FYE-HTO/3FYE-HTO_target.pdbqt | data/3F/3FYE-HTO/3FYE-HTO_decoys.pdbqt | data/3F/3FYE-HTO/3FYE-HTO_decoy_scores.csv |
3F15-HS1 | data/3F/3F15-HS1/3F15-HS1_ligand.pdbqt | data/3F/3F15-HS1/3F15-HS1_target.pdbqt | data/3F/3F15-HS1/3F15-HS1_decoys.pdbqt | data/3F/3F15-HS1/3F15-HS1_decoy_scores.csv |
3FFG-FFG | data/3F/3FFG-FFG/3FFG-FFG_ligand.pdbqt | data/3F/3FFG-FFG/3FFG-FFG_target.pdbqt | data/3F/3FFG-FFG/3FFG-FFG_decoys.pdbqt | data/3F/3FFG-FFG/3FFG-FFG_decoy_scores.csv |
3FHI-ANP | data/3F/3FHI-ANP/3FHI-ANP_ligand.pdbqt | data/3F/3FHI-ANP/3FHI-ANP_target.pdbqt | data/3F/3FHI-ANP/3FHI-ANP_decoys.pdbqt | data/3F/3FHI-ANP/3FHI-ANP_decoy_scores.csv |
3FZF-ATP | data/3F/3FZF-ATP/3FZF-ATP_ligand.pdbqt | data/3F/3FZF-ATP/3FZF-ATP_target.pdbqt | data/3F/3FZF-ATP/3FZF-ATP_decoys.pdbqt | data/3F/3FZF-ATP/3FZF-ATP_decoy_scores.csv |
3FG4-ACD | data/3F/3FG4-ACD/3FG4-ACD_ligand.pdbqt | data/3F/3FG4-ACD/3FG4-ACD_target.pdbqt | data/3F/3FG4-ACD/3FG4-ACD_decoys.pdbqt | data/3F/3FG4-ACD/3FG4-ACD_decoy_scores.csv |
3F90-FMN | data/3F/3F90-FMN/3F90-FMN_ligand.pdbqt | data/3F/3F90-FMN/3F90-FMN_target.pdbqt | data/3F/3F90-FMN/3F90-FMN_decoys.pdbqt | data/3F/3F90-FMN/3F90-FMN_decoy_scores.csv |
3FJ7-PEQ | data/3F/3FJ7-PEQ/3FJ7-PEQ_ligand.pdbqt | data/3F/3FJ7-PEQ/3FJ7-PEQ_target.pdbqt | data/3F/3FJ7-PEQ/3FJ7-PEQ_decoys.pdbqt | data/3F/3FJ7-PEQ/3FJ7-PEQ_decoy_scores.csv |
3FUD-692 | data/3F/3FUD-692/3FUD-692_ligand.pdbqt | data/3F/3FUD-692/3FUD-692_target.pdbqt | null | null |
3FCW-UDP | data/3F/3FCW-UDP/3FCW-UDP_ligand.pdbqt | data/3F/3FCW-UDP/3FCW-UDP_target.pdbqt | data/3F/3FCW-UDP/3FCW-UDP_decoys.pdbqt | data/3F/3FCW-UDP/3FCW-UDP_decoy_scores.csv |
3FT8-MOJ | data/3F/3FT8-MOJ/3FT8-MOJ_ligand.pdbqt | data/3F/3FT8-MOJ/3FT8-MOJ_target.pdbqt | data/3F/3FT8-MOJ/3FT8-MOJ_decoys.pdbqt | data/3F/3FT8-MOJ/3FT8-MOJ_decoy_scores.csv |
3FPE-TNA | data/3F/3FPE-TNA/3FPE-TNA_ligand.pdbqt | data/3F/3FPE-TNA/3FPE-TNA_target.pdbqt | data/3F/3FPE-TNA/3FPE-TNA_decoys.pdbqt | data/3F/3FPE-TNA/3FPE-TNA_decoy_scores.csv |
3FL4-FL4 | data/3F/3FL4-FL4/3FL4-FL4_ligand.pdbqt | data/3F/3FL4-FL4/3FL4-FL4_target.pdbqt | data/3F/3FL4-FL4/3FL4-FL4_decoys.pdbqt | data/3F/3FL4-FL4/3FL4-FL4_decoy_scores.csv |
3FKT-SII | data/3F/3FKT-SII/3FKT-SII_ligand.pdbqt | data/3F/3FKT-SII/3FKT-SII_target.pdbqt | data/3F/3FKT-SII/3FKT-SII_decoys.pdbqt | data/3F/3FKT-SII/3FKT-SII_decoy_scores.csv |
3FO0-BZH | data/3F/3FO0-BZH/3FO0-BZH_ligand.pdbqt | data/3F/3FO0-BZH/3FO0-BZH_target.pdbqt | data/3F/3FO0-BZH/3FO0-BZH_decoys.pdbqt | data/3F/3FO0-BZH/3FO0-BZH_decoy_scores.csv |
3FNM-AVN | data/3F/3FNM-AVN/3FNM-AVN_ligand.pdbqt | data/3F/3FNM-AVN/3FNM-AVN_target.pdbqt | data/3F/3FNM-AVN/3FNM-AVN_decoys.pdbqt | data/3F/3FNM-AVN/3FNM-AVN_decoy_scores.csv |
3FOR-ZNP | data/3F/3FOR-ZNP/3FOR-ZNP_ligand.pdbqt | data/3F/3FOR-ZNP/3FOR-ZNP_target.pdbqt | data/3F/3FOR-ZNP/3FOR-ZNP_decoys.pdbqt | data/3F/3FOR-ZNP/3FOR-ZNP_decoy_scores.csv |
3FD3-P33 | data/3F/3FD3-P33/3FD3-P33_ligand.pdbqt | data/3F/3FD3-P33/3FD3-P33_target.pdbqt | data/3F/3FD3-P33/3FD3-P33_decoys.pdbqt | data/3F/3FD3-P33/3FD3-P33_decoy_scores.csv |
3F8Z-DH1 | data/3F/3F8Z-DH1/3F8Z-DH1_ligand.pdbqt | data/3F/3F8Z-DH1/3F8Z-DH1_target.pdbqt | data/3F/3F8Z-DH1/3F8Z-DH1_decoys.pdbqt | data/3F/3F8Z-DH1/3F8Z-DH1_decoy_scores.csv |
3F47-I2C | data/3F/3F47-I2C/3F47-I2C_ligand.pdbqt | data/3F/3F47-I2C/3F47-I2C_target.pdbqt | data/3F/3F47-I2C/3F47-I2C_decoys.pdbqt | data/3F/3F47-I2C/3F47-I2C_decoy_scores.csv |
3FI3-JK2 | data/3F/3FI3-JK2/3FI3-JK2_ligand.pdbqt | data/3F/3FI3-JK2/3FI3-JK2_target.pdbqt | data/3F/3FI3-JK2/3FI3-JK2_decoys.pdbqt | data/3F/3FI3-JK2/3FI3-JK2_decoy_scores.csv |
3FQH-057 | data/3F/3FQH-057/3FQH-057_ligand.pdbqt | data/3F/3FQH-057/3FQH-057_target.pdbqt | data/3F/3FQH-057/3FQH-057_decoys.pdbqt | data/3F/3FQH-057/3FQH-057_decoy_scores.csv |
3FXU-TSU | data/3F/3FXU-TSU/3FXU-TSU_ligand.pdbqt | data/3F/3FXU-TSU/3FXU-TSU_target.pdbqt | data/3F/3FXU-TSU/3FXU-TSU_decoys.pdbqt | data/3F/3FXU-TSU/3FXU-TSU_decoy_scores.csv |
3FX4-FX4 | data/3F/3FX4-FX4/3FX4-FX4_ligand.pdbqt | data/3F/3FX4-FX4/3FX4-FX4_target.pdbqt | data/3F/3FX4-FX4/3FX4-FX4_decoys.pdbqt | data/3F/3FX4-FX4/3FX4-FX4_decoy_scores.csv |
3F6D-GTX | data/3F/3F6D-GTX/3F6D-GTX_ligand.pdbqt | data/3F/3F6D-GTX/3F6D-GTX_target.pdbqt | data/3F/3F6D-GTX/3F6D-GTX_decoys.pdbqt | data/3F/3F6D-GTX/3F6D-GTX_decoy_scores.csv |
3FKO-FKO | data/3F/3FKO-FKO/3FKO-FKO_ligand.pdbqt | data/3F/3FKO-FKO/3FKO-FKO_target.pdbqt | data/3F/3FKO-FKO/3FKO-FKO_decoys.pdbqt | data/3F/3FKO-FKO/3FKO-FKO_decoy_scores.csv |
3FY8-XCF | data/3F/3FY8-XCF/3FY8-XCF_ligand.pdbqt | data/3F/3FY8-XCF/3FY8-XCF_target.pdbqt | data/3F/3FY8-XCF/3FY8-XCF_decoys.pdbqt | data/3F/3FY8-XCF/3FY8-XCF_decoy_scores.csv |
3FC1-52P | data/3F/3FC1-52P/3FC1-52P_ligand.pdbqt | data/3F/3FC1-52P/3FC1-52P_target.pdbqt | data/3F/3FC1-52P/3FC1-52P_decoys.pdbqt | data/3F/3FC1-52P/3FC1-52P_decoy_scores.csv |
3FUN-798 | data/3F/3FUN-798/3FUN-798_ligand.pdbqt | data/3F/3FUN-798/3FUN-798_target.pdbqt | null | null |
3F1Q-ORO | data/3F/3F1Q-ORO/3F1Q-ORO_ligand.pdbqt | data/3F/3F1Q-ORO/3F1Q-ORO_target.pdbqt | data/3F/3F1Q-ORO/3F1Q-ORO_decoys.pdbqt | data/3F/3F1Q-ORO/3F1Q-ORO_decoy_scores.csv |
3FEL-B3P | data/3F/3FEL-B3P/3FEL-B3P_ligand.pdbqt | data/3F/3FEL-B3P/3FEL-B3P_target.pdbqt | data/3F/3FEL-B3P/3FEL-B3P_decoys.pdbqt | data/3F/3FEL-B3P/3FEL-B3P_decoy_scores.csv |
3F34-DIE | data/3F/3F34-DIE/3F34-DIE_ligand.pdbqt | data/3F/3F34-DIE/3F34-DIE_target.pdbqt | data/3F/3F34-DIE/3F34-DIE_decoys.pdbqt | data/3F/3F34-DIE/3F34-DIE_decoy_scores.csv |
3F7I-G13 | data/3F/3F7I-G13/3F7I-G13_ligand.pdbqt | data/3F/3F7I-G13/3F7I-G13_target.pdbqt | data/3F/3F7I-G13/3F7I-G13_decoys.pdbqt | data/3F/3F7I-G13/3F7I-G13_decoy_scores.csv |
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