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 ⌀ |
|---|---|---|---|---|
6YM4-P4Z | data/6Y/6YM4-P4Z/6YM4-P4Z_ligand.pdbqt | data/6Y/6YM4-P4Z/6YM4-P4Z_target.pdbqt | data/6Y/6YM4-P4Z/6YM4-P4Z_decoys.pdbqt | data/6Y/6YM4-P4Z/6YM4-P4Z_decoy_scores.csv |
6YU4-LMT | data/6Y/6YU4-LMT/6YU4-LMT_ligand.pdbqt | data/6Y/6YU4-LMT/6YU4-LMT_target.pdbqt | data/6Y/6YU4-LMT/6YU4-LMT_decoys.pdbqt | data/6Y/6YU4-LMT/6YU4-LMT_decoy_scores.csv |
6YC7-A5O | data/6Y/6YC7-A5O/6YC7-A5O_ligand.pdbqt | data/6Y/6YC7-A5O/6YC7-A5O_target.pdbqt | data/6Y/6YC7-A5O/6YC7-A5O_decoys.pdbqt | data/6Y/6YC7-A5O/6YC7-A5O_decoy_scores.csv |
6YXV-Q2H | data/6Y/6YXV-Q2H/6YXV-Q2H_ligand.pdbqt | data/6Y/6YXV-Q2H/6YXV-Q2H_target.pdbqt | data/6Y/6YXV-Q2H/6YXV-Q2H_decoys.pdbqt | data/6Y/6YXV-Q2H/6YXV-Q2H_decoy_scores.csv |
6YKW-OVZ | data/6Y/6YKW-OVZ/6YKW-OVZ_ligand.pdbqt | data/6Y/6YKW-OVZ/6YKW-OVZ_target.pdbqt | data/6Y/6YKW-OVZ/6YKW-OVZ_decoys.pdbqt | data/6Y/6YKW-OVZ/6YKW-OVZ_decoy_scores.csv |
6Y82-308 | data/6Y/6Y82-308/6Y82-308_ligand.pdbqt | data/6Y/6Y82-308/6Y82-308_target.pdbqt | data/6Y/6Y82-308/6Y82-308_decoys.pdbqt | data/6Y/6Y82-308/6Y82-308_decoy_scores.csv |
6Y7D-B3P | data/6Y/6Y7D-B3P/6Y7D-B3P_ligand.pdbqt | data/6Y/6Y7D-B3P/6Y7D-B3P_target.pdbqt | data/6Y/6Y7D-B3P/6Y7D-B3P_decoys.pdbqt | data/6Y/6Y7D-B3P/6Y7D-B3P_decoy_scores.csv |
6YHA-3TV | data/6Y/6YHA-3TV/6YHA-3TV_ligand.pdbqt | data/6Y/6YHA-3TV/6YHA-3TV_target.pdbqt | data/6Y/6YHA-3TV/6YHA-3TV_decoys.pdbqt | data/6Y/6YHA-3TV/6YHA-3TV_decoy_scores.csv |
6YB9-ANP | data/6Y/6YB9-ANP/6YB9-ANP_ligand.pdbqt | data/6Y/6YB9-ANP/6YB9-ANP_target.pdbqt | data/6Y/6YB9-ANP/6YB9-ANP_decoys.pdbqt | data/6Y/6YB9-ANP/6YB9-ANP_decoy_scores.csv |
6YUU-NAD | data/6Y/6YUU-NAD/6YUU-NAD_ligand.pdbqt | data/6Y/6YUU-NAD/6YUU-NAD_target.pdbqt | data/6Y/6YUU-NAD/6YUU-NAD_decoys.pdbqt | data/6Y/6YUU-NAD/6YUU-NAD_decoy_scores.csv |
6Y9S-OHK | data/6Y/6Y9S-OHK/6Y9S-OHK_ligand.pdbqt | data/6Y/6Y9S-OHK/6Y9S-OHK_target.pdbqt | data/6Y/6Y9S-OHK/6Y9S-OHK_decoys.pdbqt | data/6Y/6Y9S-OHK/6Y9S-OHK_decoy_scores.csv |
6YAC-C7Z | data/6Y/6YAC-C7Z/6YAC-C7Z_ligand.pdbqt | data/6Y/6YAC-C7Z/6YAC-C7Z_target.pdbqt | data/6Y/6YAC-C7Z/6YAC-C7Z_decoys.pdbqt | data/6Y/6YAC-C7Z/6YAC-C7Z_decoy_scores.csv |
7GSP-SGP | data/7G/7GSP-SGP/7GSP-SGP_ligand.pdbqt | data/7G/7GSP-SGP/7GSP-SGP_target.pdbqt | data/7G/7GSP-SGP/7GSP-SGP_decoys.pdbqt | data/7G/7GSP-SGP/7GSP-SGP_decoy_scores.csv |
7GCH-LPF | data/7G/7GCH-LPF/7GCH-LPF_ligand.pdbqt | data/7G/7GCH-LPF/7GCH-LPF_target.pdbqt | data/7G/7GCH-LPF/7GCH-LPF_decoys.pdbqt | data/7G/7GCH-LPF/7GCH-LPF_decoy_scores.csv |
4LFI-GNP | data/4L/4LFI-GNP/4LFI-GNP_ligand.pdbqt | data/4L/4LFI-GNP/4LFI-GNP_target.pdbqt | data/4L/4LFI-GNP/4LFI-GNP_decoys.pdbqt | data/4L/4LFI-GNP/4LFI-GNP_decoy_scores.csv |
4L4Z-D5X | data/4L/4L4Z-D5X/4L4Z-D5X_ligand.pdbqt | data/4L/4L4Z-D5X/4L4Z-D5X_target.pdbqt | data/4L/4L4Z-D5X/4L4Z-D5X_decoys.pdbqt | data/4L/4L4Z-D5X/4L4Z-D5X_decoy_scores.csv |
4LCE-NAD | data/4L/4LCE-NAD/4LCE-NAD_ligand.pdbqt | data/4L/4LCE-NAD/4LCE-NAD_target.pdbqt | data/4L/4LCE-NAD/4LCE-NAD_decoys.pdbqt | data/4L/4LCE-NAD/4LCE-NAD_decoy_scores.csv |
4LYE-HPK | data/4L/4LYE-HPK/4LYE-HPK_ligand.pdbqt | data/4L/4LYE-HPK/4LYE-HPK_target.pdbqt | data/4L/4LYE-HPK/4LYE-HPK_decoys.pdbqt | data/4L/4LYE-HPK/4LYE-HPK_decoy_scores.csv |
4LTM-FMN | data/4L/4LTM-FMN/4LTM-FMN_ligand.pdbqt | data/4L/4LTM-FMN/4LTM-FMN_target.pdbqt | data/4L/4LTM-FMN/4LTM-FMN_decoys.pdbqt | data/4L/4LTM-FMN/4LTM-FMN_decoy_scores.csv |
4LOC-BTN | data/4L/4LOC-BTN/4LOC-BTN_ligand.pdbqt | data/4L/4LOC-BTN/4LOC-BTN_target.pdbqt | data/4L/4LOC-BTN/4LOC-BTN_decoys.pdbqt | data/4L/4LOC-BTN/4LOC-BTN_decoy_scores.csv |
4LKL-ADM | data/4L/4LKL-ADM/4LKL-ADM_ligand.pdbqt | data/4L/4LKL-ADM/4LKL-ADM_target.pdbqt | data/4L/4LKL-ADM/4LKL-ADM_decoys.pdbqt | data/4L/4LKL-ADM/4LKL-ADM_decoy_scores.csv |
4LF1-CAP | data/4L/4LF1-CAP/4LF1-CAP_ligand.pdbqt | data/4L/4LF1-CAP/4LF1-CAP_target.pdbqt | data/4L/4LF1-CAP/4LF1-CAP_decoys.pdbqt | data/4L/4LF1-CAP/4LF1-CAP_decoy_scores.csv |
4LYW-21Q | data/4L/4LYW-21Q/4LYW-21Q_ligand.pdbqt | data/4L/4LYW-21Q/4LYW-21Q_target.pdbqt | data/4L/4LYW-21Q/4LYW-21Q_decoys.pdbqt | data/4L/4LYW-21Q/4LYW-21Q_decoy_scores.csv |
4LC1-GDP | data/4L/4LC1-GDP/4LC1-GDP_ligand.pdbqt | data/4L/4LC1-GDP/4LC1-GDP_target.pdbqt | data/4L/4LC1-GDP/4LC1-GDP_decoys.pdbqt | data/4L/4LC1-GDP/4LC1-GDP_decoy_scores.csv |
4LWI-FJ6 | data/4L/4LWI-FJ6/4LWI-FJ6_ligand.pdbqt | data/4L/4LWI-FJ6/4LWI-FJ6_target.pdbqt | data/4L/4LWI-FJ6/4LWI-FJ6_decoys.pdbqt | data/4L/4LWI-FJ6/4LWI-FJ6_decoy_scores.csv |
4LJ3-C2E | data/4L/4LJ3-C2E/4LJ3-C2E_ligand.pdbqt | data/4L/4LJ3-C2E/4LJ3-C2E_target.pdbqt | data/4L/4LJ3-C2E/4LJ3-C2E_decoys.pdbqt | data/4L/4LJ3-C2E/4LJ3-C2E_decoy_scores.csv |
4L9W-GNP | data/4L/4L9W-GNP/4L9W-GNP_ligand.pdbqt | data/4L/4L9W-GNP/4L9W-GNP_target.pdbqt | data/4L/4L9W-GNP/4L9W-GNP_decoys.pdbqt | data/4L/4L9W-GNP/4L9W-GNP_decoy_scores.csv |
4LCN-GNG | data/4L/4LCN-GNG/4LCN-GNG_ligand.pdbqt | data/4L/4LCN-GNG/4LCN-GNG_target.pdbqt | data/4L/4LCN-GNG/4LCN-GNG_decoys.pdbqt | data/4L/4LCN-GNG/4LCN-GNG_decoy_scores.csv |
4LW1-1XS | data/4L/4LW1-1XS/4LW1-1XS_ligand.pdbqt | data/4L/4LW1-1XS/4LW1-1XS_target.pdbqt | data/4L/4LW1-1XS/4LW1-1XS_decoys.pdbqt | data/4L/4LW1-1XS/4LW1-1XS_decoy_scores.csv |
4LBP-1WG | data/4L/4LBP-1WG/4LBP-1WG_ligand.pdbqt | data/4L/4LBP-1WG/4LBP-1WG_target.pdbqt | data/4L/4LBP-1WG/4LBP-1WG_decoys.pdbqt | data/4L/4LBP-1WG/4LBP-1WG_decoy_scores.csv |
4LUK-PA5 | data/4L/4LUK-PA5/4LUK-PA5_ligand.pdbqt | data/4L/4LUK-PA5/4LUK-PA5_target.pdbqt | data/4L/4LUK-PA5/4LUK-PA5_decoys.pdbqt | data/4L/4LUK-PA5/4LUK-PA5_decoy_scores.csv |
4LWB-H4B | data/4L/4LWB-H4B/4LWB-H4B_ligand.pdbqt | data/4L/4LWB-H4B/4LWB-H4B_target.pdbqt | data/4L/4LWB-H4B/4LWB-H4B_decoys.pdbqt | data/4L/4LWB-H4B/4LWB-H4B_decoy_scores.csv |
4LKE-GAL | data/4L/4LKE-GAL/4LKE-GAL_ligand.pdbqt | data/4L/4LKE-GAL/4LKE-GAL_target.pdbqt | data/4L/4LKE-GAL/4LKE-GAL_decoys.pdbqt | data/4L/4LKE-GAL/4LKE-GAL_decoy_scores.csv |
4LKD-GAL | data/4L/4LKD-GAL/4LKD-GAL_ligand.pdbqt | data/4L/4LKD-GAL/4LKD-GAL_target.pdbqt | data/4L/4LKD-GAL/4LKD-GAL_decoys.pdbqt | data/4L/4LKD-GAL/4LKD-GAL_decoy_scores.csv |
4L94-S46 | data/4L/4L94-S46/4L94-S46_ligand.pdbqt | data/4L/4L94-S46/4L94-S46_target.pdbqt | data/4L/4L94-S46/4L94-S46_decoys.pdbqt | data/4L/4L94-S46/4L94-S46_decoy_scores.csv |
4LLT-IPE | data/4L/4LLT-IPE/4LLT-IPE_ligand.pdbqt | data/4L/4LLT-IPE/4LLT-IPE_target.pdbqt | data/4L/4LLT-IPE/4LLT-IPE_decoys.pdbqt | data/4L/4LLT-IPE/4LLT-IPE_decoy_scores.csv |
4LS1-3X2 | data/4L/4LS1-3X2/4LS1-3X2_ligand.pdbqt | data/4L/4LS1-3X2/4LS1-3X2_target.pdbqt | data/4L/4LS1-3X2/4LS1-3X2_decoys.pdbqt | data/4L/4LS1-3X2/4LS1-3X2_decoy_scores.csv |
4LUS-TCE | data/4L/4LUS-TCE/4LUS-TCE_ligand.pdbqt | data/4L/4LUS-TCE/4LUS-TCE_target.pdbqt | data/4L/4LUS-TCE/4LUS-TCE_decoys.pdbqt | data/4L/4LUS-TCE/4LUS-TCE_decoy_scores.csv |
4LYS-2SJ | data/4L/4LYS-2SJ/4LYS-2SJ_ligand.pdbqt | data/4L/4LYS-2SJ/4LYS-2SJ_target.pdbqt | data/4L/4LYS-2SJ/4LYS-2SJ_decoys.pdbqt | data/4L/4LYS-2SJ/4LYS-2SJ_decoy_scores.csv |
4LM7-U5P | data/4L/4LM7-U5P/4LM7-U5P_ligand.pdbqt | data/4L/4LM7-U5P/4LM7-U5P_target.pdbqt | data/4L/4LM7-U5P/4LM7-U5P_decoys.pdbqt | data/4L/4LM7-U5P/4LM7-U5P_decoy_scores.csv |
4L8Q-XMM | data/4L/4L8Q-XMM/4L8Q-XMM_ligand.pdbqt | data/4L/4L8Q-XMM/4L8Q-XMM_target.pdbqt | data/4L/4L8Q-XMM/4L8Q-XMM_decoys.pdbqt | data/4L/4L8Q-XMM/4L8Q-XMM_decoy_scores.csv |
4LOQ-SB4 | data/4L/4LOQ-SB4/4LOQ-SB4_ligand.pdbqt | data/4L/4LOQ-SB4/4LOQ-SB4_target.pdbqt | data/4L/4LOQ-SB4/4LOQ-SB4_decoys.pdbqt | data/4L/4LOQ-SB4/4LOQ-SB4_decoy_scores.csv |
4L4B-CAM | data/4L/4L4B-CAM/4L4B-CAM_ligand.pdbqt | data/4L/4L4B-CAM/4L4B-CAM_target.pdbqt | data/4L/4L4B-CAM/4L4B-CAM_decoys.pdbqt | data/4L/4L4B-CAM/4L4B-CAM_decoy_scores.csv |
4LZ0-BTM | data/4L/4LZ0-BTM/4LZ0-BTM_ligand.pdbqt | data/4L/4LZ0-BTM/4LZ0-BTM_target.pdbqt | data/4L/4LZ0-BTM/4LZ0-BTM_decoys.pdbqt | data/4L/4LZ0-BTM/4LZ0-BTM_decoy_scores.csv |
4LYH-GDP | data/4L/4LYH-GDP/4LYH-GDP_ligand.pdbqt | data/4L/4LYH-GDP/4LYH-GDP_target.pdbqt | data/4L/4LYH-GDP/4LYH-GDP_decoys.pdbqt | data/4L/4LYH-GDP/4LYH-GDP_decoy_scores.csv |
4LCQ-URQ | data/4L/4LCQ-URQ/4LCQ-URQ_ligand.pdbqt | data/4L/4LCQ-URQ/4LCQ-URQ_target.pdbqt | data/4L/4LCQ-URQ/4LCQ-URQ_decoys.pdbqt | data/4L/4LCQ-URQ/4LCQ-URQ_decoy_scores.csv |
4L7S-G7K | data/4L/4L7S-G7K/4L7S-G7K_ligand.pdbqt | data/4L/4L7S-G7K/4L7S-G7K_target.pdbqt | data/4L/4L7S-G7K/4L7S-G7K_decoys.pdbqt | data/4L/4L7S-G7K/4L7S-G7K_decoy_scores.csv |
4L9I-8PR | data/4L/4L9I-8PR/4L9I-8PR_ligand.pdbqt | data/4L/4L9I-8PR/4L9I-8PR_target.pdbqt | data/4L/4L9I-8PR/4L9I-8PR_decoys.pdbqt | data/4L/4L9I-8PR/4L9I-8PR_decoy_scores.csv |
4LN7-1ZQ | data/4L/4LN7-1ZQ/4LN7-1ZQ_ligand.pdbqt | data/4L/4LN7-1ZQ/4LN7-1ZQ_target.pdbqt | data/4L/4LN7-1ZQ/4LN7-1ZQ_decoys.pdbqt | data/4L/4LN7-1ZQ/4LN7-1ZQ_decoy_scores.csv |
4L3L-5FI | data/4L/4L3L-5FI/4L3L-5FI_ligand.pdbqt | data/4L/4L3L-5FI/4L3L-5FI_target.pdbqt | data/4L/4L3L-5FI/4L3L-5FI_decoys.pdbqt | data/4L/4L3L-5FI/4L3L-5FI_decoy_scores.csv |
4LXU-T3F | data/4L/4LXU-T3F/4LXU-T3F_ligand.pdbqt | data/4L/4LXU-T3F/4LXU-T3F_target.pdbqt | data/4L/4LXU-T3F/4LXU-T3F_decoys.pdbqt | data/4L/4LXU-T3F/4LXU-T3F_decoy_scores.csv |
4LXU-MPO | data/4L/4LXU-MPO/4LXU-MPO_ligand.pdbqt | data/4L/4LXU-MPO/4LXU-MPO_target.pdbqt | data/4L/4LXU-MPO/4LXU-MPO_decoys.pdbqt | data/4L/4LXU-MPO/4LXU-MPO_decoy_scores.csv |
4LCH-1WN | data/4L/4LCH-1WN/4LCH-1WN_ligand.pdbqt | data/4L/4LCH-1WN/4LCH-1WN_target.pdbqt | data/4L/4LCH-1WN/4LCH-1WN_decoys.pdbqt | data/4L/4LCH-1WN/4LCH-1WN_decoy_scores.csv |
4L1A-AB1 | data/4L/4L1A-AB1/4L1A-AB1_ligand.pdbqt | data/4L/4L1A-AB1/4L1A-AB1_target.pdbqt | data/4L/4L1A-AB1/4L1A-AB1_decoys.pdbqt | data/4L/4L1A-AB1/4L1A-AB1_decoy_scores.csv |
4LKS-GAL | data/4L/4LKS-GAL/4LKS-GAL_ligand.pdbqt | data/4L/4LKS-GAL/4LKS-GAL_target.pdbqt | data/4L/4LKS-GAL/4LKS-GAL_decoys.pdbqt | data/4L/4LKS-GAL/4LKS-GAL_decoy_scores.csv |
4LRR-UMP | data/4L/4LRR-UMP/4LRR-UMP_ligand.pdbqt | data/4L/4LRR-UMP/4LRR-UMP_target.pdbqt | data/4L/4LRR-UMP/4LRR-UMP_decoys.pdbqt | data/4L/4LRR-UMP/4LRR-UMP_decoy_scores.csv |
4L0B-1UT | data/4L/4L0B-1UT/4L0B-1UT_ligand.pdbqt | data/4L/4L0B-1UT/4L0B-1UT_target.pdbqt | data/4L/4L0B-1UT/4L0B-1UT_decoys.pdbqt | data/4L/4L0B-1UT/4L0B-1UT_decoy_scores.csv |
4LUJ-BMP | data/4L/4LUJ-BMP/4LUJ-BMP_ligand.pdbqt | data/4L/4LUJ-BMP/4LUJ-BMP_target.pdbqt | data/4L/4LUJ-BMP/4LUJ-BMP_decoys.pdbqt | data/4L/4LUJ-BMP/4LUJ-BMP_decoy_scores.csv |
4LI4-AMP | data/4L/4LI4-AMP/4LI4-AMP_ligand.pdbqt | data/4L/4LI4-AMP/4LI4-AMP_target.pdbqt | data/4L/4LI4-AMP/4LI4-AMP_decoys.pdbqt | data/4L/4LI4-AMP/4LI4-AMP_decoy_scores.csv |
4LW7-BMP | data/4L/4LW7-BMP/4LW7-BMP_ligand.pdbqt | data/4L/4LW7-BMP/4LW7-BMP_target.pdbqt | data/4L/4LW7-BMP/4LW7-BMP_decoys.pdbqt | data/4L/4LW7-BMP/4LW7-BMP_decoy_scores.csv |
4LXM-1YU | data/4L/4LXM-1YU/4LXM-1YU_ligand.pdbqt | data/4L/4LXM-1YU/4LXM-1YU_target.pdbqt | data/4L/4LXM-1YU/4LXM-1YU_decoys.pdbqt | data/4L/4LXM-1YU/4LXM-1YU_decoy_scores.csv |
4LTW-STR | data/4L/4LTW-STR/4LTW-STR_ligand.pdbqt | data/4L/4LTW-STR/4LTW-STR_target.pdbqt | data/4L/4LTW-STR/4LTW-STR_decoys.pdbqt | data/4L/4LTW-STR/4LTW-STR_decoy_scores.csv |
4LBV-GNP | data/4L/4LBV-GNP/4LBV-GNP_ligand.pdbqt | data/4L/4LBV-GNP/4LBV-GNP_target.pdbqt | data/4L/4LBV-GNP/4LBV-GNP_decoys.pdbqt | data/4L/4LBV-GNP/4LBV-GNP_decoy_scores.csv |
4LRG-1XB | data/4L/4LRG-1XB/4LRG-1XB_ligand.pdbqt | data/4L/4LRG-1XB/4LRG-1XB_target.pdbqt | data/4L/4LRG-1XB/4LRG-1XB_decoys.pdbqt | data/4L/4LRG-1XB/4LRG-1XB_decoy_scores.csv |
4L8W-MTX | data/4L/4L8W-MTX/4L8W-MTX_ligand.pdbqt | data/4L/4L8W-MTX/4L8W-MTX_target.pdbqt | data/4L/4L8W-MTX/4L8W-MTX_decoys.pdbqt | data/4L/4L8W-MTX/4L8W-MTX_decoy_scores.csv |
4LM0-5NI | data/4L/4LM0-5NI/4LM0-5NI_ligand.pdbqt | data/4L/4LM0-5NI/4LM0-5NI_target.pdbqt | data/4L/4LM0-5NI/4LM0-5NI_decoys.pdbqt | data/4L/4LM0-5NI/4LM0-5NI_decoy_scores.csv |
4LEC-SAH | data/4L/4LEC-SAH/4LEC-SAH_ligand.pdbqt | data/4L/4LEC-SAH/4LEC-SAH_target.pdbqt | data/4L/4LEC-SAH/4LEC-SAH_decoys.pdbqt | data/4L/4LEC-SAH/4LEC-SAH_decoy_scores.csv |
4LBW-GNP | data/4L/4LBW-GNP/4LBW-GNP_ligand.pdbqt | data/4L/4LBW-GNP/4LBW-GNP_target.pdbqt | data/4L/4LBW-GNP/4LBW-GNP_decoys.pdbqt | data/4L/4LBW-GNP/4LBW-GNP_decoy_scores.csv |
4LRW-GDP | data/4L/4LRW-GDP/4LRW-GDP_ligand.pdbqt | data/4L/4LRW-GDP/4LRW-GDP_target.pdbqt | data/4L/4LRW-GDP/4LRW-GDP_decoys.pdbqt | data/4L/4LRW-GDP/4LRW-GDP_decoy_scores.csv |
4LC4-ADN | data/4L/4LC4-ADN/4LC4-ADN_ligand.pdbqt | data/4L/4LC4-ADN/4LC4-ADN_target.pdbqt | data/4L/4LC4-ADN/4LC4-ADN_decoys.pdbqt | data/4L/4LC4-ADN/4LC4-ADN_decoy_scores.csv |
4LTC-EC6 | data/4L/4LTC-EC6/4LTC-EC6_ligand.pdbqt | data/4L/4LTC-EC6/4LTC-EC6_target.pdbqt | data/4L/4LTC-EC6/4LTC-EC6_decoys.pdbqt | data/4L/4LTC-EC6/4LTC-EC6_decoy_scores.csv |
4LWH-FJ5 | data/4L/4LWH-FJ5/4LWH-FJ5_ligand.pdbqt | data/4L/4LWH-FJ5/4LWH-FJ5_target.pdbqt | data/4L/4LWH-FJ5/4LWH-FJ5_decoys.pdbqt | data/4L/4LWH-FJ5/4LWH-FJ5_decoy_scores.csv |
4LWX-NDG | data/4L/4LWX-NDG/4LWX-NDG_ligand.pdbqt | data/4L/4LWX-NDG/4LWX-NDG_target.pdbqt | data/4L/4LWX-NDG/4LWX-NDG_decoys.pdbqt | data/4L/4LWX-NDG/4LWX-NDG_decoy_scores.csv |
4LPH-YL3 | data/4L/4LPH-YL3/4LPH-YL3_ligand.pdbqt | data/4L/4LPH-YL3/4LPH-YL3_target.pdbqt | data/4L/4LPH-YL3/4LPH-YL3_decoys.pdbqt | data/4L/4LPH-YL3/4LPH-YL3_decoy_scores.csv |
4L77-CNL | data/4L/4L77-CNL/4L77-CNL_ligand.pdbqt | data/4L/4L77-CNL/4L77-CNL_target.pdbqt | data/4L/4L77-CNL/4L77-CNL_decoys.pdbqt | data/4L/4L77-CNL/4L77-CNL_decoy_scores.csv |
4L0I-1UW | data/4L/4L0I-1UW/4L0I-1UW_ligand.pdbqt | data/4L/4L0I-1UW/4L0I-1UW_target.pdbqt | data/4L/4L0I-1UW/4L0I-1UW_decoys.pdbqt | data/4L/4L0I-1UW/4L0I-1UW_decoy_scores.csv |
4L1X-STR | data/4L/4L1X-STR/4L1X-STR_ligand.pdbqt | data/4L/4L1X-STR/4L1X-STR_target.pdbqt | data/4L/4L1X-STR/4L1X-STR_decoys.pdbqt | data/4L/4L1X-STR/4L1X-STR_decoy_scores.csv |
4L0L-PFV | data/4L/4L0L-PFV/4L0L-PFV_ligand.pdbqt | data/4L/4L0L-PFV/4L0L-PFV_target.pdbqt | data/4L/4L0L-PFV/4L0L-PFV_decoys.pdbqt | data/4L/4L0L-PFV/4L0L-PFV_decoy_scores.csv |
4LD2-CTN | data/4L/4LD2-CTN/4LD2-CTN_ligand.pdbqt | data/4L/4LD2-CTN/4LD2-CTN_target.pdbqt | data/4L/4LD2-CTN/4LD2-CTN_decoys.pdbqt | data/4L/4LD2-CTN/4LD2-CTN_decoy_scores.csv |
4L8W-DGL | data/4L/4L8W-DGL/4L8W-DGL_ligand.pdbqt | data/4L/4L8W-DGL/4L8W-DGL_target.pdbqt | data/4L/4L8W-DGL/4L8W-DGL_decoys.pdbqt | data/4L/4L8W-DGL/4L8W-DGL_decoy_scores.csv |
4L5B-UDP | data/4L/4L5B-UDP/4L5B-UDP_ligand.pdbqt | data/4L/4L5B-UDP/4L5B-UDP_target.pdbqt | data/4L/4L5B-UDP/4L5B-UDP_decoys.pdbqt | data/4L/4L5B-UDP/4L5B-UDP_decoy_scores.csv |
4LDJ-GDP | data/4L/4LDJ-GDP/4LDJ-GDP_ligand.pdbqt | data/4L/4LDJ-GDP/4LDJ-GDP_target.pdbqt | data/4L/4LDJ-GDP/4LDJ-GDP_decoys.pdbqt | data/4L/4LDJ-GDP/4LDJ-GDP_decoy_scores.csv |
4LY1-NHE | data/4L/4LY1-NHE/4LY1-NHE_ligand.pdbqt | data/4L/4LY1-NHE/4LY1-NHE_target.pdbqt | data/4L/4LY1-NHE/4LY1-NHE_decoys.pdbqt | data/4L/4LY1-NHE/4LY1-NHE_decoy_scores.csv |
4L5A-TBN | data/4L/4L5A-TBN/4L5A-TBN_ligand.pdbqt | data/4L/4L5A-TBN/4L5A-TBN_target.pdbqt | data/4L/4L5A-TBN/4L5A-TBN_decoys.pdbqt | data/4L/4L5A-TBN/4L5A-TBN_decoy_scores.csv |
4L7J-1W2 | data/4L/4L7J-1W2/4L7J-1W2_ligand.pdbqt | data/4L/4L7J-1W2/4L7J-1W2_target.pdbqt | data/4L/4L7J-1W2/4L7J-1W2_decoys.pdbqt | data/4L/4L7J-1W2/4L7J-1W2_decoy_scores.csv |
4LM6-DBV | data/4L/4LM6-DBV/4LM6-DBV_ligand.pdbqt | data/4L/4LM6-DBV/4LM6-DBV_target.pdbqt | data/4L/4LM6-DBV/4LM6-DBV_decoys.pdbqt | data/4L/4LM6-DBV/4LM6-DBV_decoy_scores.csv |
4LNJ-PLR | data/4L/4LNJ-PLR/4LNJ-PLR_ligand.pdbqt | data/4L/4LNJ-PLR/4LNJ-PLR_target.pdbqt | data/4L/4LNJ-PLR/4LNJ-PLR_decoys.pdbqt | data/4L/4LNJ-PLR/4LNJ-PLR_decoy_scores.csv |
4LYF-GDP | data/4L/4LYF-GDP/4LYF-GDP_ligand.pdbqt | data/4L/4LYF-GDP/4LYF-GDP_target.pdbqt | data/4L/4LYF-GDP/4LYF-GDP_decoys.pdbqt | data/4L/4LYF-GDP/4LYF-GDP_decoy_scores.csv |
4LGE-1Y0 | data/4L/4LGE-1Y0/4LGE-1Y0_ligand.pdbqt | data/4L/4LGE-1Y0/4LGE-1Y0_target.pdbqt | data/4L/4LGE-1Y0/4LGE-1Y0_decoys.pdbqt | data/4L/4LGE-1Y0/4LGE-1Y0_decoy_scores.csv |
4LC8-BMP | data/4L/4LC8-BMP/4LC8-BMP_ligand.pdbqt | data/4L/4LC8-BMP/4LC8-BMP_target.pdbqt | data/4L/4LC8-BMP/4LC8-BMP_decoys.pdbqt | data/4L/4LC8-BMP/4LC8-BMP_decoy_scores.csv |
4LI6-1XO | data/4L/4LI6-1XO/4LI6-1XO_ligand.pdbqt | data/4L/4LI6-1XO/4LI6-1XO_target.pdbqt | data/4L/4LI6-1XO/4LI6-1XO_decoys.pdbqt | data/4L/4LI6-1XO/4LI6-1XO_decoy_scores.csv |
4L09-1UR | data/4L/4L09-1UR/4L09-1UR_ligand.pdbqt | data/4L/4L09-1UR/4L09-1UR_target.pdbqt | data/4L/4L09-1UR/4L09-1UR_decoys.pdbqt | data/4L/4L09-1UR/4L09-1UR_decoy_scores.csv |
4L4A-CAM | data/4L/4L4A-CAM/4L4A-CAM_ligand.pdbqt | data/4L/4L4A-CAM/4L4A-CAM_target.pdbqt | data/4L/4L4A-CAM/4L4A-CAM_decoys.pdbqt | data/4L/4L4A-CAM/4L4A-CAM_decoy_scores.csv |
4LXQ-TYD | data/4L/4LXQ-TYD/4LXQ-TYD_ligand.pdbqt | data/4L/4LXQ-TYD/4LXQ-TYD_target.pdbqt | data/4L/4LXQ-TYD/4LXQ-TYD_decoys.pdbqt | data/4L/4LXQ-TYD/4LXQ-TYD_decoy_scores.csv |
4LI7-1XP | data/4L/4LI7-1XP/4LI7-1XP_ligand.pdbqt | data/4L/4LI7-1XP/4LI7-1XP_target.pdbqt | data/4L/4LI7-1XP/4LI7-1XP_decoys.pdbqt | data/4L/4LI7-1XP/4LI7-1XP_decoy_scores.csv |
4LS8-1XG | data/4L/4LS8-1XG/4LS8-1XG_ligand.pdbqt | data/4L/4LS8-1XG/4LS8-1XG_target.pdbqt | data/4L/4LS8-1XG/4LS8-1XG_decoys.pdbqt | data/4L/4LS8-1XG/4LS8-1XG_decoy_scores.csv |
4LY3-T3Q | data/4L/4LY3-T3Q/4LY3-T3Q_ligand.pdbqt | data/4L/4LY3-T3Q/4LY3-T3Q_target.pdbqt | data/4L/4LY3-T3Q/4LY3-T3Q_decoys.pdbqt | data/4L/4LY3-T3Q/4LY3-T3Q_decoy_scores.csv |
4LLQ-PG6 | data/4L/4LLQ-PG6/4LLQ-PG6_ligand.pdbqt | data/4L/4LLQ-PG6/4LLQ-PG6_target.pdbqt | data/4L/4LLQ-PG6/4LLQ-PG6_decoys.pdbqt | data/4L/4LLQ-PG6/4LLQ-PG6_decoy_scores.csv |
4L49-CAM | data/4L/4L49-CAM/4L49-CAM_ligand.pdbqt | data/4L/4L49-CAM/4L49-CAM_target.pdbqt | data/4L/4L49-CAM/4L49-CAM_decoys.pdbqt | data/4L/4L49-CAM/4L49-CAM_decoy_scores.csv |
4L1O-1VL | data/4L/4L1O-1VL/4L1O-1VL_ligand.pdbqt | data/4L/4L1O-1VL/4L1O-1VL_target.pdbqt | data/4L/4L1O-1VL/4L1O-1VL_decoys.pdbqt | data/4L/4L1O-1VL/4L1O-1VL_decoy_scores.csv |
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