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 ⌀ |
|---|---|---|---|---|
5DJ5-GR2 | data/5D/5DJ5-GR2/5DJ5-GR2_ligand.pdbqt | data/5D/5DJ5-GR2/5DJ5-GR2_target.pdbqt | data/5D/5DJ5-GR2/5DJ5-GR2_decoys.pdbqt | data/5D/5DJ5-GR2/5DJ5-GR2_decoy_scores.csv |
5D41-57N | data/5D/5D41-57N/5D41-57N_ligand.pdbqt | data/5D/5D41-57N/5D41-57N_target.pdbqt | data/5D/5D41-57N/5D41-57N_decoys.pdbqt | data/5D/5D41-57N/5D41-57N_decoy_scores.csv |
5D59-78M | data/5D/5D59-78M/5D59-78M_ligand.pdbqt | data/5D/5D59-78M/5D59-78M_target.pdbqt | data/5D/5D59-78M/5D59-78M_decoys.pdbqt | data/5D/5D59-78M/5D59-78M_decoy_scores.csv |
5DPA-5F2 | data/5D/5DPA-5F2/5DPA-5F2_ligand.pdbqt | data/5D/5DPA-5F2/5DPA-5F2_target.pdbqt | data/5D/5DPA-5F2/5DPA-5F2_decoys.pdbqt | data/5D/5DPA-5F2/5DPA-5F2_decoy_scores.csv |
5DZ3-5JX | data/5D/5DZ3-5JX/5DZ3-5JX_ligand.pdbqt | data/5D/5DZ3-5JX/5DZ3-5JX_target.pdbqt | data/5D/5DZ3-5JX/5DZ3-5JX_decoys.pdbqt | data/5D/5DZ3-5JX/5DZ3-5JX_decoy_scores.csv |
5D2T-6VP | data/5D/5D2T-6VP/5D2T-6VP_ligand.pdbqt | data/5D/5D2T-6VP/5D2T-6VP_target.pdbqt | data/5D/5D2T-6VP/5D2T-6VP_decoys.pdbqt | data/5D/5D2T-6VP/5D2T-6VP_decoy_scores.csv |
5D0C-E0B | data/5D/5D0C-E0B/5D0C-E0B_ligand.pdbqt | data/5D/5D0C-E0B/5D0C-E0B_target.pdbqt | data/5D/5D0C-E0B/5D0C-E0B_decoys.pdbqt | data/5D/5D0C-E0B/5D0C-E0B_decoy_scores.csv |
5D2A-PHB | data/5D/5D2A-PHB/5D2A-PHB_ligand.pdbqt | data/5D/5D2A-PHB/5D2A-PHB_target.pdbqt | data/5D/5D2A-PHB/5D2A-PHB_decoys.pdbqt | data/5D/5D2A-PHB/5D2A-PHB_decoy_scores.csv |
5DW1-5GD | data/5D/5DW1-5GD/5DW1-5GD_ligand.pdbqt | data/5D/5DW1-5GD/5DW1-5GD_target.pdbqt | data/5D/5DW1-5GD/5DW1-5GD_decoys.pdbqt | data/5D/5DW1-5GD/5DW1-5GD_decoy_scores.csv |
5DK6-ADE | data/5D/5DK6-ADE/5DK6-ADE_ligand.pdbqt | data/5D/5DK6-ADE/5DK6-ADE_target.pdbqt | data/5D/5DK6-ADE/5DK6-ADE_decoys.pdbqt | data/5D/5DK6-ADE/5DK6-ADE_decoy_scores.csv |
5DEB-U5P | data/5D/5DEB-U5P/5DEB-U5P_ligand.pdbqt | data/5D/5DEB-U5P/5DEB-U5P_target.pdbqt | data/5D/5DEB-U5P/5DEB-U5P_decoys.pdbqt | data/5D/5DEB-U5P/5DEB-U5P_decoy_scores.csv |
5DNU-KKN | data/5D/5DNU-KKN/5DNU-KKN_ligand.pdbqt | data/5D/5DNU-KKN/5DNU-KKN_target.pdbqt | data/5D/5DNU-KKN/5DNU-KKN_decoys.pdbqt | data/5D/5DNU-KKN/5DNU-KKN_decoy_scores.csv |
5DIV-5BH | data/5D/5DIV-5BH/5DIV-5BH_ligand.pdbqt | data/5D/5DIV-5BH/5DIV-5BH_target.pdbqt | data/5D/5DIV-5BH/5DIV-5BH_decoys.pdbqt | data/5D/5DIV-5BH/5DIV-5BH_decoy_scores.csv |
5DIT-5B8 | data/5D/5DIT-5B8/5DIT-5B8_ligand.pdbqt | data/5D/5DIT-5B8/5DIT-5B8_target.pdbqt | data/5D/5DIT-5B8/5DIT-5B8_decoys.pdbqt | data/5D/5DIT-5B8/5DIT-5B8_decoy_scores.csv |
5DCZ-59B | data/5D/5DCZ-59B/5DCZ-59B_ligand.pdbqt | data/5D/5DCZ-59B/5DCZ-59B_target.pdbqt | data/5D/5DCZ-59B/5DCZ-59B_decoys.pdbqt | data/5D/5DCZ-59B/5DCZ-59B_decoy_scores.csv |
5DIA-5E6 | data/5D/5DIA-5E6/5DIA-5E6_ligand.pdbqt | data/5D/5DIA-5E6/5DIA-5E6_target.pdbqt | data/5D/5DIA-5E6/5DIA-5E6_decoys.pdbqt | data/5D/5DIA-5E6/5DIA-5E6_decoy_scores.csv |
5DM0-SAH | data/5D/5DM0-SAH/5DM0-SAH_ligand.pdbqt | data/5D/5DM0-SAH/5DM0-SAH_target.pdbqt | data/5D/5DM0-SAH/5DM0-SAH_decoys.pdbqt | data/5D/5DM0-SAH/5DM0-SAH_decoy_scores.csv |
5D59-PE5 | data/5D/5D59-PE5/5D59-PE5_ligand.pdbqt | data/5D/5D59-PE5/5D59-PE5_target.pdbqt | data/5D/5D59-PE5/5D59-PE5_decoys.pdbqt | data/5D/5D59-PE5/5D59-PE5_decoy_scores.csv |
5DVP-DRW | data/5D/5DVP-DRW/5DVP-DRW_ligand.pdbqt | data/5D/5DVP-DRW/5DVP-DRW_target.pdbqt | data/5D/5DVP-DRW/5DVP-DRW_decoys.pdbqt | data/5D/5DVP-DRW/5DVP-DRW_decoy_scores.csv |
5DJG-A3P | data/5D/5DJG-A3P/5DJG-A3P_ligand.pdbqt | data/5D/5DJG-A3P/5DJG-A3P_target.pdbqt | null | null |
5DQ8-FLF | data/5D/5DQ8-FLF/5DQ8-FLF_ligand.pdbqt | data/5D/5DQ8-FLF/5DQ8-FLF_target.pdbqt | data/5D/5DQ8-FLF/5DQ8-FLF_decoys.pdbqt | data/5D/5DQ8-FLF/5DQ8-FLF_decoy_scores.csv |
5DY7-5GT | data/5D/5DY7-5GT/5DY7-5GT_ligand.pdbqt | data/5D/5DY7-5GT/5DY7-5GT_target.pdbqt | data/5D/5DY7-5GT/5DY7-5GT_decoys.pdbqt | data/5D/5DY7-5GT/5DY7-5GT_decoy_scores.csv |
5DD7-ANP | data/5D/5DD7-ANP/5DD7-ANP_ligand.pdbqt | data/5D/5DD7-ANP/5DD7-ANP_target.pdbqt | data/5D/5DD7-ANP/5DD7-ANP_decoys.pdbqt | data/5D/5DD7-ANP/5DD7-ANP_decoy_scores.csv |
5D7P-AR6 | data/5D/5D7P-AR6/5D7P-AR6_ligand.pdbqt | data/5D/5D7P-AR6/5D7P-AR6_target.pdbqt | data/5D/5D7P-AR6/5D7P-AR6_decoys.pdbqt | data/5D/5D7P-AR6/5D7P-AR6_decoy_scores.csv |
5DBE-0JO | data/5D/5DBE-0JO/5DBE-0JO_ligand.pdbqt | data/5D/5DBE-0JO/5DBE-0JO_target.pdbqt | data/5D/5DBE-0JO/5DBE-0JO_decoys.pdbqt | data/5D/5DBE-0JO/5DBE-0JO_decoy_scores.csv |
5D05-PHE | data/5D/5D05-PHE/5D05-PHE_ligand.pdbqt | data/5D/5D05-PHE/5D05-PHE_target.pdbqt | data/5D/5D05-PHE/5D05-PHE_decoys.pdbqt | data/5D/5D05-PHE/5D05-PHE_decoy_scores.csv |
5DRY-5EK | data/5D/5DRY-5EK/5DRY-5EK_ligand.pdbqt | data/5D/5DRY-5EK/5DRY-5EK_target.pdbqt | data/5D/5DRY-5EK/5DRY-5EK_decoys.pdbqt | data/5D/5DRY-5EK/5DRY-5EK_decoy_scores.csv |
5DR2-ATP | data/5D/5DR2-ATP/5DR2-ATP_ligand.pdbqt | data/5D/5DR2-ATP/5DR2-ATP_target.pdbqt | data/5D/5DR2-ATP/5DR2-ATP_decoys.pdbqt | data/5D/5DR2-ATP/5DR2-ATP_decoy_scores.csv |
5DZH-5KG | data/5D/5DZH-5KG/5DZH-5KG_ligand.pdbqt | data/5D/5DZH-5KG/5DZH-5KG_target.pdbqt | data/5D/5DZH-5KG/5DZH-5KG_decoys.pdbqt | data/5D/5DZH-5KG/5DZH-5KG_decoy_scores.csv |
5DF7-59H | data/5D/5DF7-59H/5DF7-59H_ligand.pdbqt | data/5D/5DF7-59H/5DF7-59H_target.pdbqt | data/5D/5DF7-59H/5DF7-59H_decoys.pdbqt | data/5D/5DF7-59H/5DF7-59H_decoy_scores.csv |
5D5M-2LJ | data/5D/5D5M-2LJ/5D5M-2LJ_ligand.pdbqt | data/5D/5D5M-2LJ/5D5M-2LJ_target.pdbqt | data/5D/5D5M-2LJ/5D5M-2LJ_decoys.pdbqt | data/5D/5D5M-2LJ/5D5M-2LJ_decoy_scores.csv |
5DEP-UD1 | data/5D/5DEP-UD1/5DEP-UD1_ligand.pdbqt | data/5D/5DEP-UD1/5DEP-UD1_target.pdbqt | data/5D/5DEP-UD1/5DEP-UD1_decoys.pdbqt | data/5D/5DEP-UD1/5DEP-UD1_decoy_scores.csv |
5D24-L26 | data/5D/5D24-L26/5D24-L26_ligand.pdbqt | data/5D/5D24-L26/5D24-L26_target.pdbqt | data/5D/5D24-L26/5D24-L26_decoys.pdbqt | data/5D/5D24-L26/5D24-L26_decoy_scores.csv |
5DGI-ADP | data/5D/5DGI-ADP/5DGI-ADP_ligand.pdbqt | data/5D/5DGI-ADP/5DGI-ADP_target.pdbqt | data/5D/5DGI-ADP/5DGI-ADP_decoys.pdbqt | data/5D/5DGI-ADP/5DGI-ADP_decoy_scores.csv |
5DBH-0JO | data/5D/5DBH-0JO/5DBH-0JO_ligand.pdbqt | data/5D/5DBH-0JO/5DBH-0JO_target.pdbqt | data/5D/5DBH-0JO/5DBH-0JO_decoys.pdbqt | data/5D/5DBH-0JO/5DBH-0JO_decoy_scores.csv |
5DNR-ATP | data/5D/5DNR-ATP/5DNR-ATP_ligand.pdbqt | data/5D/5DNR-ATP/5DNR-ATP_target.pdbqt | data/5D/5DNR-ATP/5DNR-ATP_decoys.pdbqt | data/5D/5DNR-ATP/5DNR-ATP_decoy_scores.csv |
5DDE-5A0 | data/5D/5DDE-5A0/5DDE-5A0_ligand.pdbqt | data/5D/5DDE-5A0/5DDE-5A0_target.pdbqt | data/5D/5DDE-5A0/5DDE-5A0_decoys.pdbqt | data/5D/5DDE-5A0/5DDE-5A0_decoy_scores.csv |
5D6Q-57V | data/5D/5D6Q-57V/5D6Q-57V_ligand.pdbqt | data/5D/5D6Q-57V/5D6Q-57V_target.pdbqt | data/5D/5D6Q-57V/5D6Q-57V_decoys.pdbqt | data/5D/5D6Q-57V/5D6Q-57V_decoy_scores.csv |
5DR7-5HJ | data/5D/5DR7-5HJ/5DR7-5HJ_ligand.pdbqt | data/5D/5DR7-5HJ/5DR7-5HJ_target.pdbqt | data/5D/5DR7-5HJ/5DR7-5HJ_decoys.pdbqt | data/5D/5DR7-5HJ/5DR7-5HJ_decoy_scores.csv |
5DRR-5EN | data/5D/5DRR-5EN/5DRR-5EN_ligand.pdbqt | data/5D/5DRR-5EN/5DRR-5EN_target.pdbqt | data/5D/5DRR-5EN/5DRR-5EN_decoys.pdbqt | data/5D/5DRR-5EN/5DRR-5EN_decoy_scores.csv |
5DQ4-5HQ | data/5D/5DQ4-5HQ/5DQ4-5HQ_ligand.pdbqt | data/5D/5DQ4-5HQ/5DQ4-5HQ_target.pdbqt | data/5D/5DQ4-5HQ/5DQ4-5HQ_decoys.pdbqt | data/5D/5DQ4-5HQ/5DQ4-5HQ_decoy_scores.csv |
5DJE-BTB | data/5D/5DJE-BTB/5DJE-BTB_ligand.pdbqt | data/5D/5DJE-BTB/5DJE-BTB_target.pdbqt | data/5D/5DJE-BTB/5DJE-BTB_decoys.pdbqt | data/5D/5DJE-BTB/5DJE-BTB_decoy_scores.csv |
5DQ5-5HS | data/5D/5DQ5-5HS/5DQ5-5HS_ligand.pdbqt | data/5D/5DQ5-5HS/5DQ5-5HS_target.pdbqt | data/5D/5DQ5-5HS/5DQ5-5HS_decoys.pdbqt | data/5D/5DQ5-5HS/5DQ5-5HS_decoy_scores.csv |
5D3Y-4IP | data/5D/5D3Y-4IP/5D3Y-4IP_ligand.pdbqt | data/5D/5D3Y-4IP/5D3Y-4IP_target.pdbqt | data/5D/5D3Y-4IP/5D3Y-4IP_decoys.pdbqt | data/5D/5D3Y-4IP/5D3Y-4IP_decoy_scores.csv |
5D5D-PE5 | data/5D/5D5D-PE5/5D5D-PE5_ligand.pdbqt | data/5D/5D5D-PE5/5D5D-PE5_target.pdbqt | data/5D/5D5D-PE5/5D5D-PE5_decoys.pdbqt | data/5D/5D5D-PE5/5D5D-PE5_decoy_scores.csv |
5DE3-GNP | data/5D/5DE3-GNP/5DE3-GNP_ligand.pdbqt | data/5D/5DE3-GNP/5DE3-GNP_target.pdbqt | data/5D/5DE3-GNP/5DE3-GNP_decoys.pdbqt | data/5D/5DE3-GNP/5DE3-GNP_decoy_scores.csv |
5DJV-5BL | data/5D/5DJV-5BL/5DJV-5BL_ligand.pdbqt | data/5D/5DJV-5BL/5DJV-5BL_target.pdbqt | data/5D/5DJV-5BL/5DJV-5BL_decoys.pdbqt | data/5D/5DJV-5BL/5DJV-5BL_decoy_scores.csv |
5DNK-SAH | data/5D/5DNK-SAH/5DNK-SAH_ligand.pdbqt | data/5D/5DNK-SAH/5DNK-SAH_target.pdbqt | data/5D/5DNK-SAH/5DNK-SAH_decoys.pdbqt | data/5D/5DNK-SAH/5DNK-SAH_decoy_scores.csv |
5DEX-5E0 | data/5D/5DEX-5E0/5DEX-5E0_ligand.pdbqt | data/5D/5DEX-5E0/5DEX-5E0_target.pdbqt | data/5D/5DEX-5E0/5DEX-5E0_decoys.pdbqt | data/5D/5DEX-5E0/5DEX-5E0_decoy_scores.csv |
5DZC-ANP | data/5D/5DZC-ANP/5DZC-ANP_ligand.pdbqt | data/5D/5DZC-ANP/5DZC-ANP_target.pdbqt | data/5D/5DZC-ANP/5DZC-ANP_decoys.pdbqt | data/5D/5DZC-ANP/5DZC-ANP_decoy_scores.csv |
5DM2-SAH | data/5D/5DM2-SAH/5DM2-SAH_ligand.pdbqt | data/5D/5DM2-SAH/5DM2-SAH_target.pdbqt | data/5D/5DM2-SAH/5DM2-SAH_decoys.pdbqt | data/5D/5DM2-SAH/5DM2-SAH_decoy_scores.csv |
5DY8-5K4 | data/5D/5DY8-5K4/5DY8-5K4_ligand.pdbqt | data/5D/5DY8-5K4/5DY8-5K4_target.pdbqt | data/5D/5DY8-5K4/5DY8-5K4_decoys.pdbqt | data/5D/5DY8-5K4/5DY8-5K4_decoy_scores.csv |
5DLD-UD1 | data/5D/5DLD-UD1/5DLD-UD1_ligand.pdbqt | data/5D/5DLD-UD1/5DLD-UD1_target.pdbqt | data/5D/5DLD-UD1/5DLD-UD1_decoys.pdbqt | data/5D/5DLD-UD1/5DLD-UD1_decoy_scores.csv |
5D3V-FLC | data/5D/5D3V-FLC/5D3V-FLC_ligand.pdbqt | data/5D/5D3V-FLC/5D3V-FLC_target.pdbqt | data/5D/5D3V-FLC/5D3V-FLC_decoys.pdbqt | data/5D/5D3V-FLC/5D3V-FLC_decoy_scores.csv |
5D00-U5P | data/5D/5D00-U5P/5D00-U5P_ligand.pdbqt | data/5D/5D00-U5P/5D00-U5P_target.pdbqt | data/5D/5D00-U5P/5D00-U5P_decoys.pdbqt | data/5D/5D00-U5P/5D00-U5P_decoy_scores.csv |
5D5F-PE5 | data/5D/5D5F-PE5/5D5F-PE5_ligand.pdbqt | data/5D/5D5F-PE5/5D5F-PE5_target.pdbqt | data/5D/5D5F-PE5/5D5F-PE5_decoys.pdbqt | data/5D/5D5F-PE5/5D5F-PE5_decoy_scores.csv |
5DHK-FAR | data/5D/5DHK-FAR/5DHK-FAR_ligand.pdbqt | data/5D/5DHK-FAR/5DHK-FAR_target.pdbqt | data/5D/5DHK-FAR/5DHK-FAR_decoys.pdbqt | data/5D/5DHK-FAR/5DHK-FAR_decoy_scores.csv |
5DEL-FMN | data/5D/5DEL-FMN/5DEL-FMN_ligand.pdbqt | data/5D/5DEL-FMN/5DEL-FMN_target.pdbqt | data/5D/5DEL-FMN/5DEL-FMN_decoys.pdbqt | data/5D/5DEL-FMN/5DEL-FMN_decoy_scores.csv |
5D59-PHE | data/5D/5D59-PHE/5D59-PHE_ligand.pdbqt | data/5D/5D59-PHE/5D59-PHE_target.pdbqt | data/5D/5D59-PHE/5D59-PHE_decoys.pdbqt | data/5D/5D59-PHE/5D59-PHE_decoy_scores.csv |
5DN8-GDP | data/5D/5DN8-GDP/5DN8-GDP_ligand.pdbqt | data/5D/5DN8-GDP/5DN8-GDP_target.pdbqt | data/5D/5DN8-GDP/5DN8-GDP_decoys.pdbqt | data/5D/5DN8-GDP/5DN8-GDP_decoy_scores.csv |
5DP0-5ES | data/5D/5DP0-5ES/5DP0-5ES_ligand.pdbqt | data/5D/5DP0-5ES/5DP0-5ES_target.pdbqt | data/5D/5DP0-5ES/5DP0-5ES_decoys.pdbqt | data/5D/5DP0-5ES/5DP0-5ES_decoy_scores.csv |
5DB0-58P | data/5D/5DB0-58P/5DB0-58P_ligand.pdbqt | data/5D/5DB0-58P/5DB0-58P_target.pdbqt | data/5D/5DB0-58P/5DB0-58P_decoys.pdbqt | data/5D/5DB0-58P/5DB0-58P_decoy_scores.csv |
5DF1-58X | data/5D/5DF1-58X/5DF1-58X_ligand.pdbqt | data/5D/5DF1-58X/5DF1-58X_target.pdbqt | data/5D/5DF1-58X/5DF1-58X_decoys.pdbqt | data/5D/5DF1-58X/5DF1-58X_decoy_scores.csv |
5DJH-AMP | data/5D/5DJH-AMP/5DJH-AMP_ligand.pdbqt | data/5D/5DJH-AMP/5DJH-AMP_target.pdbqt | data/5D/5DJH-AMP/5DJH-AMP_decoys.pdbqt | data/5D/5DJH-AMP/5DJH-AMP_decoy_scores.csv |
5DEL-LDA | data/5D/5DEL-LDA/5DEL-LDA_ligand.pdbqt | data/5D/5DEL-LDA/5DEL-LDA_target.pdbqt | data/5D/5DEL-LDA/5DEL-LDA_decoys.pdbqt | data/5D/5DEL-LDA/5DEL-LDA_decoy_scores.csv |
5DEW-59N | data/5D/5DEW-59N/5DEW-59N_ligand.pdbqt | data/5D/5DEW-59N/5DEW-59N_target.pdbqt | data/5D/5DEW-59N/5DEW-59N_decoys.pdbqt | data/5D/5DEW-59N/5DEW-59N_decoy_scores.csv |
5D7Q-4I5 | data/5D/5D7Q-4I5/5D7Q-4I5_ligand.pdbqt | data/5D/5D7Q-4I5/5D7Q-4I5_target.pdbqt | data/5D/5D7Q-4I5/5D7Q-4I5_decoys.pdbqt | data/5D/5D7Q-4I5/5D7Q-4I5_decoy_scores.csv |
5DUO-OLC | data/5D/5DUO-OLC/5DUO-OLC_ligand.pdbqt | data/5D/5DUO-OLC/5DUO-OLC_target.pdbqt | data/5D/5DUO-OLC/5DUO-OLC_decoys.pdbqt | data/5D/5DUO-OLC/5DUO-OLC_decoy_scores.csv |
5DY2-DIN | data/5D/5DY2-DIN/5DY2-DIN_ligand.pdbqt | data/5D/5DY2-DIN/5DY2-DIN_target.pdbqt | data/5D/5DY2-DIN/5DY2-DIN_decoys.pdbqt | data/5D/5DY2-DIN/5DY2-DIN_decoy_scores.csv |
5D7I-30W | data/5D/5D7I-30W/5D7I-30W_ligand.pdbqt | data/5D/5D7I-30W/5D7I-30W_target.pdbqt | data/5D/5D7I-30W/5D7I-30W_decoys.pdbqt | data/5D/5D7I-30W/5D7I-30W_decoy_scores.csv |
5DRS-5EF | data/5D/5DRS-5EF/5DRS-5EF_ligand.pdbqt | data/5D/5DRS-5EF/5DRS-5EF_target.pdbqt | data/5D/5DRS-5EF/5DRS-5EF_decoys.pdbqt | data/5D/5DRS-5EF/5DRS-5EF_decoy_scores.csv |
5DYD-5K1 | data/5D/5DYD-5K1/5DYD-5K1_ligand.pdbqt | data/5D/5DYD-5K1/5DYD-5K1_target.pdbqt | data/5D/5DYD-5K1/5DYD-5K1_decoys.pdbqt | data/5D/5DYD-5K1/5DYD-5K1_decoy_scores.csv |
5DMZ-ADP | data/5D/5DMZ-ADP/5DMZ-ADP_ligand.pdbqt | data/5D/5DMZ-ADP/5DMZ-ADP_target.pdbqt | data/5D/5DMZ-ADP/5DMZ-ADP_decoys.pdbqt | data/5D/5DMZ-ADP/5DMZ-ADP_decoy_scores.csv |
5D5C-PE5 | data/5D/5D5C-PE5/5D5C-PE5_ligand.pdbqt | data/5D/5D5C-PE5/5D5C-PE5_target.pdbqt | data/5D/5D5C-PE5/5D5C-PE5_decoys.pdbqt | data/5D/5D5C-PE5/5D5C-PE5_decoy_scores.csv |
5DM1-SAH | data/5D/5DM1-SAH/5DM1-SAH_ligand.pdbqt | data/5D/5DM1-SAH/5DM1-SAH_target.pdbqt | data/5D/5DM1-SAH/5DM1-SAH_decoys.pdbqt | data/5D/5DM1-SAH/5DM1-SAH_decoy_scores.csv |
5DVI-BGC | data/5D/5DVI-BGC/5DVI-BGC_ligand.pdbqt | data/5D/5DVI-BGC/5DVI-BGC_target.pdbqt | data/5D/5DVI-BGC/5DVI-BGC_decoys.pdbqt | data/5D/5DVI-BGC/5DVI-BGC_decoy_scores.csv |
5DQP-PE4 | data/5D/5DQP-PE4/5DQP-PE4_ligand.pdbqt | data/5D/5DQP-PE4/5DQP-PE4_target.pdbqt | data/5D/5DQP-PE4/5DQP-PE4_decoys.pdbqt | data/5D/5DQP-PE4/5DQP-PE4_decoy_scores.csv |
5DU9-UM2 | data/5D/5DU9-UM2/5DU9-UM2_ligand.pdbqt | data/5D/5DU9-UM2/5DU9-UM2_target.pdbqt | data/5D/5DU9-UM2/5DU9-UM2_decoys.pdbqt | data/5D/5DU9-UM2/5DU9-UM2_decoy_scores.csv |
5D42-TMP | data/5D/5D42-TMP/5D42-TMP_ligand.pdbqt | data/5D/5D42-TMP/5D42-TMP_target.pdbqt | data/5D/5D42-TMP/5D42-TMP_decoys.pdbqt | data/5D/5D42-TMP/5D42-TMP_decoy_scores.csv |
5D55-FLC | data/5D/5D55-FLC/5D55-FLC_ligand.pdbqt | data/5D/5D55-FLC/5D55-FLC_target.pdbqt | data/5D/5D55-FLC/5D55-FLC_decoys.pdbqt | data/5D/5D55-FLC/5D55-FLC_decoy_scores.csv |
5DZ0-5K0 | data/5D/5DZ0-5K0/5DZ0-5K0_ligand.pdbqt | data/5D/5DZ0-5K0/5DZ0-5K0_target.pdbqt | data/5D/5DZ0-5K0/5DZ0-5K0_decoys.pdbqt | data/5D/5DZ0-5K0/5DZ0-5K0_decoy_scores.csv |
5DV2-C5P | data/5D/5DV2-C5P/5DV2-C5P_ligand.pdbqt | data/5D/5DV2-C5P/5DV2-C5P_target.pdbqt | data/5D/5DV2-C5P/5DV2-C5P_decoys.pdbqt | data/5D/5DV2-C5P/5DV2-C5P_decoy_scores.csv |
5D4U-SAM | data/5D/5D4U-SAM/5D4U-SAM_ligand.pdbqt | data/5D/5D4U-SAM/5D4U-SAM_target.pdbqt | data/5D/5D4U-SAM/5D4U-SAM_decoys.pdbqt | data/5D/5D4U-SAM/5D4U-SAM_decoy_scores.csv |
5DU4-5FF | data/5D/5DU4-5FF/5DU4-5FF_ligand.pdbqt | data/5D/5DU4-5FF/5DU4-5FF_target.pdbqt | data/5D/5DU4-5FF/5DU4-5FF_decoys.pdbqt | data/5D/5DU4-5FF/5DU4-5FF_decoy_scores.csv |
5DO8-BGC | data/5D/5DO8-BGC/5DO8-BGC_ligand.pdbqt | data/5D/5DO8-BGC/5DO8-BGC_target.pdbqt | data/5D/5DO8-BGC/5DO8-BGC_decoys.pdbqt | data/5D/5DO8-BGC/5DO8-BGC_decoy_scores.csv |
5DAQ-58D | data/5D/5DAQ-58D/5DAQ-58D_ligand.pdbqt | data/5D/5DAQ-58D/5DAQ-58D_target.pdbqt | data/5D/5DAQ-58D/5DAQ-58D_decoys.pdbqt | data/5D/5DAQ-58D/5DAQ-58D_decoy_scores.csv |
5D54-PE5 | data/5D/5D54-PE5/5D54-PE5_ligand.pdbqt | data/5D/5D54-PE5/5D54-PE5_target.pdbqt | data/5D/5D54-PE5/5D54-PE5_decoys.pdbqt | data/5D/5D54-PE5/5D54-PE5_decoy_scores.csv |
7DQ5-8PZ | data/7D/7DQ5-8PZ/7DQ5-8PZ_ligand.pdbqt | data/7D/7DQ5-8PZ/7DQ5-8PZ_target.pdbqt | data/7D/7DQ5-8PZ/7DQ5-8PZ_decoys.pdbqt | data/7D/7DQ5-8PZ/7DQ5-8PZ_decoy_scores.csv |
7DPP-MYC | data/7D/7DPP-MYC/7DPP-MYC_ligand.pdbqt | data/7D/7DPP-MYC/7DPP-MYC_target.pdbqt | data/7D/7DPP-MYC/7DPP-MYC_decoys.pdbqt | data/7D/7DPP-MYC/7DPP-MYC_decoy_scores.csv |
7DT8-HH9 | data/7D/7DT8-HH9/7DT8-HH9_ligand.pdbqt | data/7D/7DT8-HH9/7DT8-HH9_target.pdbqt | data/7D/7DT8-HH9/7DT8-HH9_decoys.pdbqt | data/7D/7DT8-HH9/7DT8-HH9_decoy_scores.csv |
7D9E-DON | data/7D/7D9E-DON/7D9E-DON_ligand.pdbqt | data/7D/7D9E-DON/7D9E-DON_target.pdbqt | data/7D/7D9E-DON/7D9E-DON_decoys.pdbqt | data/7D/7D9E-DON/7D9E-DON_decoy_scores.csv |
7DZE-PLM | data/7D/7DZE-PLM/7DZE-PLM_ligand.pdbqt | data/7D/7DZE-PLM/7DZE-PLM_target.pdbqt | data/7D/7DZE-PLM/7DZE-PLM_decoys.pdbqt | data/7D/7DZE-PLM/7DZE-PLM_decoy_scores.csv |
7DON-GTP | data/7D/7DON-GTP/7DON-GTP_ligand.pdbqt | data/7D/7DON-GTP/7DON-GTP_target.pdbqt | data/7D/7DON-GTP/7DON-GTP_decoys.pdbqt | data/7D/7DON-GTP/7DON-GTP_decoy_scores.csv |
7DEL-H4L | data/7D/7DEL-H4L/7DEL-H4L_ligand.pdbqt | data/7D/7DEL-H4L/7DEL-H4L_target.pdbqt | data/7D/7DEL-H4L/7DEL-H4L_decoys.pdbqt | data/7D/7DEL-H4L/7DEL-H4L_decoy_scores.csv |
7DKZ-LUT | data/7D/7DKZ-LUT/7DKZ-LUT_ligand.pdbqt | data/7D/7DKZ-LUT/7DKZ-LUT_target.pdbqt | data/7D/7DKZ-LUT/7DKZ-LUT_decoys.pdbqt | data/7D/7DKZ-LUT/7DKZ-LUT_decoy_scores.csv |
7DYJ-ATP | data/7D/7DYJ-ATP/7DYJ-ATP_ligand.pdbqt | data/7D/7DYJ-ATP/7DYJ-ATP_target.pdbqt | data/7D/7DYJ-ATP/7DYJ-ATP_decoys.pdbqt | data/7D/7DYJ-ATP/7DYJ-ATP_decoy_scores.csv |
7DGF-H60 | data/7D/7DGF-H60/7DGF-H60_ligand.pdbqt | data/7D/7DGF-H60/7DGF-H60_target.pdbqt | data/7D/7DGF-H60/7DGF-H60_decoys.pdbqt | data/7D/7DGF-H60/7DGF-H60_decoy_scores.csv |
7DKT-GLF | data/7D/7DKT-GLF/7DKT-GLF_ligand.pdbqt | data/7D/7DKT-GLF/7DKT-GLF_target.pdbqt | data/7D/7DKT-GLF/7DKT-GLF_decoys.pdbqt | data/7D/7DKT-GLF/7DKT-GLF_decoy_scores.csv |
7DPH-GNP | data/7D/7DPH-GNP/7DPH-GNP_ligand.pdbqt | data/7D/7DPH-GNP/7DPH-GNP_target.pdbqt | data/7D/7DPH-GNP/7DPH-GNP_decoys.pdbqt | data/7D/7DPH-GNP/7DPH-GNP_decoy_scores.csv |
7DB1-DC1 | data/7D/7DB1-DC1/7DB1-DC1_ligand.pdbqt | data/7D/7DB1-DC1/7DB1-DC1_target.pdbqt | data/7D/7DB1-DC1/7DB1-DC1_decoys.pdbqt | data/7D/7DB1-DC1/7DB1-DC1_decoy_scores.csv |
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