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 ⌀ |
|---|---|---|---|---|
5M62-GLC | data/5M/5M62-GLC/5M62-GLC_ligand.pdbqt | data/5M/5M62-GLC/5M62-GLC_target.pdbqt | data/5M/5M62-GLC/5M62-GLC_decoys.pdbqt | data/5M/5M62-GLC/5M62-GLC_decoy_scores.csv |
5MRS-AES | data/5M/5MRS-AES/5MRS-AES_ligand.pdbqt | data/5M/5MRS-AES/5MRS-AES_target.pdbqt | data/5M/5MRS-AES/5MRS-AES_decoys.pdbqt | data/5M/5MRS-AES/5MRS-AES_decoy_scores.csv |
5M1T-C2E | data/5M/5M1T-C2E/5M1T-C2E_ligand.pdbqt | data/5M/5M1T-C2E/5M1T-C2E_target.pdbqt | data/5M/5M1T-C2E/5M1T-C2E_decoys.pdbqt | data/5M/5M1T-C2E/5M1T-C2E_decoy_scores.csv |
5MGU-PHE | data/5M/5MGU-PHE/5MGU-PHE_ligand.pdbqt | data/5M/5MGU-PHE/5MGU-PHE_target.pdbqt | data/5M/5MGU-PHE/5MGU-PHE_decoys.pdbqt | data/5M/5MGU-PHE/5MGU-PHE_decoy_scores.csv |
5MJM-CYC | data/5M/5MJM-CYC/5MJM-CYC_ligand.pdbqt | data/5M/5MJM-CYC/5MJM-CYC_target.pdbqt | data/5M/5MJM-CYC/5MJM-CYC_decoys.pdbqt | data/5M/5MJM-CYC/5MJM-CYC_decoy_scores.csv |
5MFV-5PX | data/5M/5MFV-5PX/5MFV-5PX_ligand.pdbqt | data/5M/5MFV-5PX/5MFV-5PX_target.pdbqt | data/5M/5MFV-5PX/5MFV-5PX_decoys.pdbqt | data/5M/5MFV-5PX/5MFV-5PX_decoy_scores.csv |
5M4C-7EY | data/5M/5M4C-7EY/5M4C-7EY_ligand.pdbqt | data/5M/5M4C-7EY/5M4C-7EY_target.pdbqt | data/5M/5M4C-7EY/5M4C-7EY_decoys.pdbqt | data/5M/5M4C-7EY/5M4C-7EY_decoy_scores.csv |
5MNP-MRZ | data/5M/5MNP-MRZ/5MNP-MRZ_ligand.pdbqt | data/5M/5MNP-MRZ/5MNP-MRZ_target.pdbqt | data/5M/5MNP-MRZ/5MNP-MRZ_decoys.pdbqt | data/5M/5MNP-MRZ/5MNP-MRZ_decoy_scores.csv |
5MGG-7MU | data/5M/5MGG-7MU/5MGG-7MU_ligand.pdbqt | data/5M/5MGG-7MU/5MGG-7MU_target.pdbqt | data/5M/5MGG-7MU/5MGG-7MU_decoys.pdbqt | data/5M/5MGG-7MU/5MGG-7MU_decoy_scores.csv |
5MW3-5JT | data/5M/5MW3-5JT/5MW3-5JT_ligand.pdbqt | data/5M/5MW3-5JT/5MW3-5JT_target.pdbqt | data/5M/5MW3-5JT/5MW3-5JT_decoys.pdbqt | data/5M/5MW3-5JT/5MW3-5JT_decoy_scores.csv |
5MW4-5JU | data/5M/5MW4-5JU/5MW4-5JU_ligand.pdbqt | data/5M/5MW4-5JU/5MW4-5JU_target.pdbqt | data/5M/5MW4-5JU/5MW4-5JU_decoys.pdbqt | data/5M/5MW4-5JU/5MW4-5JU_decoy_scores.csv |
5MQG-F31 | data/5M/5MQG-F31/5MQG-F31_ligand.pdbqt | data/5M/5MQG-F31/5MQG-F31_target.pdbqt | data/5M/5MQG-F31/5MQG-F31_decoys.pdbqt | data/5M/5MQG-F31/5MQG-F31_decoy_scores.csv |
5MMV-WE0 | data/5M/5MMV-WE0/5MMV-WE0_ligand.pdbqt | data/5M/5MMV-WE0/5MMV-WE0_target.pdbqt | data/5M/5MMV-WE0/5MMV-WE0_decoys.pdbqt | data/5M/5MMV-WE0/5MMV-WE0_decoy_scores.csv |
5M4I-7FC | data/5M/5M4I-7FC/5M4I-7FC_ligand.pdbqt | data/5M/5M4I-7FC/5M4I-7FC_target.pdbqt | data/5M/5M4I-7FC/5M4I-7FC_decoys.pdbqt | data/5M/5M4I-7FC/5M4I-7FC_decoy_scores.csv |
5MSV-PNS | data/5M/5MSV-PNS/5MSV-PNS_ligand.pdbqt | data/5M/5MSV-PNS/5MSV-PNS_target.pdbqt | data/5M/5MSV-PNS/5MSV-PNS_decoys.pdbqt | data/5M/5MSV-PNS/5MSV-PNS_decoy_scores.csv |
5M8X-BEN | data/5M/5M8X-BEN/5M8X-BEN_ligand.pdbqt | data/5M/5M8X-BEN/5M8X-BEN_target.pdbqt | data/5M/5M8X-BEN/5M8X-BEN_decoys.pdbqt | data/5M/5M8X-BEN/5M8X-BEN_decoy_scores.csv |
5MZJ-TEP | data/5M/5MZJ-TEP/5MZJ-TEP_ligand.pdbqt | data/5M/5MZJ-TEP/5MZJ-TEP_target.pdbqt | data/5M/5MZJ-TEP/5MZJ-TEP_decoys.pdbqt | data/5M/5MZJ-TEP/5MZJ-TEP_decoy_scores.csv |
5MSQ-AMP | data/5M/5MSQ-AMP/5MSQ-AMP_ligand.pdbqt | data/5M/5MSQ-AMP/5MSQ-AMP_target.pdbqt | data/5M/5MSQ-AMP/5MSQ-AMP_decoys.pdbqt | data/5M/5MSQ-AMP/5MSQ-AMP_decoy_scores.csv |
11BG-U2G | data/11/11BG-U2G/11BG-U2G_ligand.pdbqt | data/11/11BG-U2G/11BG-U2G_target.pdbqt | data/11/11BG-U2G/11BG-U2G_decoys.pdbqt | data/11/11BG-U2G/11BG-U2G_decoy_scores.csv |
11BA-UPA | data/11/11BA-UPA/11BA-UPA_ligand.pdbqt | data/11/11BA-UPA/11BA-UPA_target.pdbqt | data/11/11BA-UPA/11BA-UPA_decoys.pdbqt | data/11/11BA-UPA/11BA-UPA_decoy_scores.csv |
11GS-EAA | data/11/11GS-EAA/11GS-EAA_ligand.pdbqt | data/11/11GS-EAA/11GS-EAA_target.pdbqt | data/11/11GS-EAA/11GS-EAA_decoys.pdbqt | data/11/11GS-EAA/11GS-EAA_decoy_scores.csv |
6INL-AJR | data/6I/6INL-AJR/6INL-AJR_ligand.pdbqt | data/6I/6INL-AJR/6INL-AJR_target.pdbqt | data/6I/6INL-AJR/6INL-AJR_decoys.pdbqt | data/6I/6INL-AJR/6INL-AJR_decoy_scores.csv |
6I6T-H5B | data/6I/6I6T-H5B/6I6T-H5B_ligand.pdbqt | data/6I/6I6T-H5B/6I6T-H5B_target.pdbqt | data/6I/6I6T-H5B/6I6T-H5B_decoys.pdbqt | data/6I/6I6T-H5B/6I6T-H5B_decoy_scores.csv |
6IXN-FLC | data/6I/6IXN-FLC/6IXN-FLC_ligand.pdbqt | data/6I/6IXN-FLC/6IXN-FLC_target.pdbqt | data/6I/6IXN-FLC/6IXN-FLC_decoys.pdbqt | data/6I/6IXN-FLC/6IXN-FLC_decoy_scores.csv |
6IXT-NAD | data/6I/6IXT-NAD/6IXT-NAD_ligand.pdbqt | data/6I/6IXT-NAD/6IXT-NAD_target.pdbqt | data/6I/6IXT-NAD/6IXT-NAD_decoys.pdbqt | data/6I/6IXT-NAD/6IXT-NAD_decoy_scores.csv |
6I72-SAH | data/6I/6I72-SAH/6I72-SAH_ligand.pdbqt | data/6I/6I72-SAH/6I72-SAH_target.pdbqt | data/6I/6I72-SAH/6I72-SAH_decoys.pdbqt | data/6I/6I72-SAH/6I72-SAH_decoy_scores.csv |
6I22-FMN | data/6I/6I22-FMN/6I22-FMN_ligand.pdbqt | data/6I/6I22-FMN/6I22-FMN_target.pdbqt | data/6I/6I22-FMN/6I22-FMN_decoys.pdbqt | data/6I/6I22-FMN/6I22-FMN_decoy_scores.csv |
6INI-UDP | data/6I/6INI-UDP/6INI-UDP_ligand.pdbqt | data/6I/6INI-UDP/6INI-UDP_target.pdbqt | data/6I/6INI-UDP/6INI-UDP_decoys.pdbqt | data/6I/6INI-UDP/6INI-UDP_decoy_scores.csv |
6I67-H42 | data/6I/6I67-H42/6I67-H42_ligand.pdbqt | data/6I/6I67-H42/6I67-H42_target.pdbqt | data/6I/6I67-H42/6I67-H42_decoys.pdbqt | data/6I/6I67-H42/6I67-H42_decoy_scores.csv |
6IBO-12V | data/6I/6IBO-12V/6IBO-12V_ligand.pdbqt | data/6I/6IBO-12V/6IBO-12V_target.pdbqt | data/6I/6IBO-12V/6IBO-12V_decoys.pdbqt | data/6I/6IBO-12V/6IBO-12V_decoy_scores.csv |
6IH5-A7R | data/6I/6IH5-A7R/6IH5-A7R_ligand.pdbqt | data/6I/6IH5-A7R/6IH5-A7R_target.pdbqt | data/6I/6IH5-A7R/6IH5-A7R_decoys.pdbqt | data/6I/6IH5-A7R/6IH5-A7R_decoy_scores.csv |
6I4K-BTB | data/6I/6I4K-BTB/6I4K-BTB_ligand.pdbqt | data/6I/6I4K-BTB/6I4K-BTB_target.pdbqt | data/6I/6I4K-BTB/6I4K-BTB_decoys.pdbqt | data/6I/6I4K-BTB/6I4K-BTB_decoy_scores.csv |
6ITD-IKT | data/6I/6ITD-IKT/6ITD-IKT_ligand.pdbqt | data/6I/6ITD-IKT/6ITD-IKT_target.pdbqt | data/6I/6ITD-IKT/6ITD-IKT_decoys.pdbqt | data/6I/6ITD-IKT/6ITD-IKT_decoy_scores.csv |
6IH3-A7R | data/6I/6IH3-A7R/6IH3-A7R_ligand.pdbqt | data/6I/6IH3-A7R/6IH3-A7R_target.pdbqt | data/6I/6IH3-A7R/6IH3-A7R_decoys.pdbqt | data/6I/6IH3-A7R/6IH3-A7R_decoy_scores.csv |
6I6G-H4N | data/6I/6I6G-H4N/6I6G-H4N_ligand.pdbqt | data/6I/6I6G-H4N/6I6G-H4N_target.pdbqt | data/6I/6I6G-H4N/6I6G-H4N_decoys.pdbqt | data/6I/6I6G-H4N/6I6G-H4N_decoy_scores.csv |
6IJL-A8U | data/6I/6IJL-A8U/6IJL-A8U_ligand.pdbqt | data/6I/6IJL-A8U/6IJL-A8U_target.pdbqt | data/6I/6IJL-A8U/6IJL-A8U_decoys.pdbqt | data/6I/6IJL-A8U/6IJL-A8U_decoy_scores.csv |
6ITJ-AXU | data/6I/6ITJ-AXU/6ITJ-AXU_ligand.pdbqt | data/6I/6ITJ-AXU/6ITJ-AXU_target.pdbqt | data/6I/6ITJ-AXU/6ITJ-AXU_decoys.pdbqt | data/6I/6ITJ-AXU/6ITJ-AXU_decoy_scores.csv |
6IYB-GTP | data/6I/6IYB-GTP/6IYB-GTP_ligand.pdbqt | data/6I/6IYB-GTP/6IYB-GTP_target.pdbqt | data/6I/6IYB-GTP/6IYB-GTP_decoys.pdbqt | data/6I/6IYB-GTP/6IYB-GTP_decoy_scores.csv |
6IF2-GTP | data/6I/6IF2-GTP/6IF2-GTP_ligand.pdbqt | data/6I/6IF2-GTP/6IF2-GTP_target.pdbqt | data/6I/6IF2-GTP/6IF2-GTP_decoys.pdbqt | data/6I/6IF2-GTP/6IF2-GTP_decoy_scores.csv |
6I74-H5Z | data/6I/6I74-H5Z/6I74-H5Z_ligand.pdbqt | data/6I/6I74-H5Z/6I74-H5Z_target.pdbqt | data/6I/6I74-H5Z/6I74-H5Z_decoys.pdbqt | data/6I/6I74-H5Z/6I74-H5Z_decoy_scores.csv |
6IHE-NAD | data/6I/6IHE-NAD/6IHE-NAD_ligand.pdbqt | data/6I/6IHE-NAD/6IHE-NAD_target.pdbqt | data/6I/6IHE-NAD/6IHE-NAD_decoys.pdbqt | data/6I/6IHE-NAD/6IHE-NAD_decoy_scores.csv |
6I3D-SFG | data/6I/6I3D-SFG/6I3D-SFG_ligand.pdbqt | data/6I/6I3D-SFG/6I3D-SFG_target.pdbqt | data/6I/6I3D-SFG/6I3D-SFG_decoys.pdbqt | data/6I/6I3D-SFG/6I3D-SFG_decoy_scores.csv |
6IX5-B0L | data/6I/6IX5-B0L/6IX5-B0L_ligand.pdbqt | data/6I/6IX5-B0L/6IX5-B0L_target.pdbqt | data/6I/6IX5-B0L/6IX5-B0L_decoys.pdbqt | data/6I/6IX5-B0L/6IX5-B0L_decoy_scores.csv |
6IPM-DCP | data/6I/6IPM-DCP/6IPM-DCP_ligand.pdbqt | data/6I/6IPM-DCP/6IPM-DCP_target.pdbqt | data/6I/6IPM-DCP/6IPM-DCP_decoys.pdbqt | data/6I/6IPM-DCP/6IPM-DCP_decoy_scores.csv |
6INH-AQ9 | data/6I/6INH-AQ9/6INH-AQ9_ligand.pdbqt | data/6I/6INH-AQ9/6INH-AQ9_target.pdbqt | data/6I/6INH-AQ9/6INH-AQ9_decoys.pdbqt | data/6I/6INH-AQ9/6INH-AQ9_decoy_scores.csv |
6I4M-ADP | data/6I/6I4M-ADP/6I4M-ADP_ligand.pdbqt | data/6I/6I4M-ADP/6I4M-ADP_target.pdbqt | data/6I/6I4M-ADP/6I4M-ADP_decoys.pdbqt | data/6I/6I4M-ADP/6I4M-ADP_decoy_scores.csv |
6I4D-ATP | data/6I/6I4D-ATP/6I4D-ATP_ligand.pdbqt | data/6I/6I4D-ATP/6I4D-ATP_target.pdbqt | data/6I/6I4D-ATP/6I4D-ATP_decoys.pdbqt | data/6I/6I4D-ATP/6I4D-ATP_decoy_scores.csv |
6IS6-RET | data/6I/6IS6-RET/6IS6-RET_ligand.pdbqt | data/6I/6IS6-RET/6IS6-RET_target.pdbqt | data/6I/6IS6-RET/6IS6-RET_decoys.pdbqt | data/6I/6IS6-RET/6IS6-RET_decoy_scores.csv |
6IDJ-ORO | data/6I/6IDJ-ORO/6IDJ-ORO_ligand.pdbqt | data/6I/6IDJ-ORO/6IDJ-ORO_target.pdbqt | data/6I/6IDJ-ORO/6IDJ-ORO_decoys.pdbqt | data/6I/6IDJ-ORO/6IDJ-ORO_decoy_scores.csv |
6I0W-M4S | data/6I/6I0W-M4S/6I0W-M4S_ligand.pdbqt | data/6I/6I0W-M4S/6I0W-M4S_target.pdbqt | data/6I/6I0W-M4S/6I0W-M4S_decoys.pdbqt | data/6I/6I0W-M4S/6I0W-M4S_decoy_scores.csv |
6IZN-B1O | data/6I/6IZN-B1O/6IZN-B1O_ligand.pdbqt | data/6I/6IZN-B1O/6IZN-B1O_target.pdbqt | data/6I/6IZN-B1O/6IZN-B1O_decoys.pdbqt | data/6I/6IZN-B1O/6IZN-B1O_decoy_scores.csv |
6I14-GZN | data/6I/6I14-GZN/6I14-GZN_ligand.pdbqt | data/6I/6I14-GZN/6I14-GZN_target.pdbqt | data/6I/6I14-GZN/6I14-GZN_decoys.pdbqt | data/6I/6I14-GZN/6I14-GZN_decoy_scores.csv |
6IMI-AH6 | data/6I/6IMI-AH6/6IMI-AH6_ligand.pdbqt | data/6I/6IMI-AH6/6IMI-AH6_target.pdbqt | data/6I/6IMI-AH6/6IMI-AH6_decoys.pdbqt | data/6I/6IMI-AH6/6IMI-AH6_decoy_scores.csv |
6IL3-CXS | data/6I/6IL3-CXS/6IL3-CXS_ligand.pdbqt | data/6I/6IL3-CXS/6IL3-CXS_target.pdbqt | data/6I/6IL3-CXS/6IL3-CXS_decoys.pdbqt | data/6I/6IL3-CXS/6IL3-CXS_decoy_scores.csv |
6IPH-DTP | data/6I/6IPH-DTP/6IPH-DTP_ligand.pdbqt | data/6I/6IPH-DTP/6IPH-DTP_target.pdbqt | data/6I/6IPH-DTP/6IPH-DTP_decoys.pdbqt | data/6I/6IPH-DTP/6IPH-DTP_decoy_scores.csv |
6I23-9O9 | data/6I/6I23-9O9/6I23-9O9_ligand.pdbqt | data/6I/6I23-9O9/6I23-9O9_target.pdbqt | data/6I/6I23-9O9/6I23-9O9_decoys.pdbqt | data/6I/6I23-9O9/6I23-9O9_decoy_scores.csv |
6IRZ-SAH | data/6I/6IRZ-SAH/6IRZ-SAH_ligand.pdbqt | data/6I/6IRZ-SAH/6IRZ-SAH_target.pdbqt | data/6I/6IRZ-SAH/6IRZ-SAH_decoys.pdbqt | data/6I/6IRZ-SAH/6IRZ-SAH_decoy_scores.csv |
6I4K-ATP | data/6I/6I4K-ATP/6I4K-ATP_ligand.pdbqt | data/6I/6I4K-ATP/6I4K-ATP_target.pdbqt | data/6I/6I4K-ATP/6I4K-ATP_decoys.pdbqt | data/6I/6I4K-ATP/6I4K-ATP_decoy_scores.csv |
6I9M-2HG | data/6I/6I9M-2HG/6I9M-2HG_ligand.pdbqt | data/6I/6I9M-2HG/6I9M-2HG_target.pdbqt | data/6I/6I9M-2HG/6I9M-2HG_decoys.pdbqt | data/6I/6I9M-2HG/6I9M-2HG_decoy_scores.csv |
6IPZ-O4B | data/6I/6IPZ-O4B/6IPZ-O4B_ligand.pdbqt | data/6I/6IPZ-O4B/6IPZ-O4B_target.pdbqt | data/6I/6IPZ-O4B/6IPZ-O4B_decoys.pdbqt | data/6I/6IPZ-O4B/6IPZ-O4B_decoy_scores.csv |
6I6K-SLX | data/6I/6I6K-SLX/6I6K-SLX_ligand.pdbqt | data/6I/6I6K-SLX/6I6K-SLX_target.pdbqt | data/6I/6I6K-SLX/6I6K-SLX_decoys.pdbqt | data/6I/6I6K-SLX/6I6K-SLX_decoy_scores.csv |
6IE8-CHD | data/6I/6IE8-CHD/6IE8-CHD_ligand.pdbqt | data/6I/6IE8-CHD/6IE8-CHD_target.pdbqt | data/6I/6IE8-CHD/6IE8-CHD_decoys.pdbqt | data/6I/6IE8-CHD/6IE8-CHD_decoy_scores.csv |
6I3C-SAM | data/6I/6I3C-SAM/6I3C-SAM_ligand.pdbqt | data/6I/6I3C-SAM/6I3C-SAM_target.pdbqt | data/6I/6I3C-SAM/6I3C-SAM_decoys.pdbqt | data/6I/6I3C-SAM/6I3C-SAM_decoy_scores.csv |
6I65-H3Z | data/6I/6I65-H3Z/6I65-H3Z_ligand.pdbqt | data/6I/6I65-H3Z/6I65-H3Z_target.pdbqt | data/6I/6I65-H3Z/6I65-H3Z_decoys.pdbqt | data/6I/6I65-H3Z/6I65-H3Z_decoy_scores.csv |
6I1N-JFQ | data/6I/6I1N-JFQ/6I1N-JFQ_ligand.pdbqt | data/6I/6I1N-JFQ/6I1N-JFQ_target.pdbqt | data/6I/6I1N-JFQ/6I1N-JFQ_decoys.pdbqt | data/6I/6I1N-JFQ/6I1N-JFQ_decoy_scores.csv |
6I8Y-2OD | data/6I/6I8Y-2OD/6I8Y-2OD_ligand.pdbqt | data/6I/6I8Y-2OD/6I8Y-2OD_target.pdbqt | data/6I/6I8Y-2OD/6I8Y-2OD_decoys.pdbqt | data/6I/6I8Y-2OD/6I8Y-2OD_decoy_scores.csv |
6I77-H5Q | data/6I/6I77-H5Q/6I77-H5Q_ligand.pdbqt | data/6I/6I77-H5Q/6I77-H5Q_target.pdbqt | data/6I/6I77-H5Q/6I77-H5Q_decoys.pdbqt | data/6I/6I77-H5Q/6I77-H5Q_decoy_scores.csv |
6I73-H6N | data/6I/6I73-H6N/6I73-H6N_ligand.pdbqt | data/6I/6I73-H6N/6I73-H6N_target.pdbqt | data/6I/6I73-H6N/6I73-H6N_decoys.pdbqt | data/6I/6I73-H6N/6I73-H6N_decoy_scores.csv |
6IME-ISY | data/6I/6IME-ISY/6IME-ISY_ligand.pdbqt | data/6I/6IME-ISY/6IME-ISY_target.pdbqt | data/6I/6IME-ISY/6IME-ISY_decoys.pdbqt | data/6I/6IME-ISY/6IME-ISY_decoy_scores.csv |
6IH7-4BW | data/6I/6IH7-4BW/6IH7-4BW_ligand.pdbqt | data/6I/6IH7-4BW/6IH7-4BW_target.pdbqt | data/6I/6IH7-4BW/6IH7-4BW_decoys.pdbqt | data/6I/6IH7-4BW/6IH7-4BW_decoy_scores.csv |
6INK-AKU | data/6I/6INK-AKU/6INK-AKU_ligand.pdbqt | data/6I/6INK-AKU/6INK-AKU_target.pdbqt | data/6I/6INK-AKU/6INK-AKU_decoys.pdbqt | data/6I/6INK-AKU/6INK-AKU_decoy_scores.csv |
6IEZ-A50 | data/6I/6IEZ-A50/6IEZ-A50_ligand.pdbqt | data/6I/6IEZ-A50/6IEZ-A50_target.pdbqt | data/6I/6IEZ-A50/6IEZ-A50_decoys.pdbqt | data/6I/6IEZ-A50/6IEZ-A50_decoy_scores.csv |
6I6Z-TJE | data/6I/6I6Z-TJE/6I6Z-TJE_ligand.pdbqt | data/6I/6I6Z-TJE/6I6Z-TJE_target.pdbqt | data/6I/6I6Z-TJE/6I6Z-TJE_decoys.pdbqt | data/6I/6I6Z-TJE/6I6Z-TJE_decoy_scores.csv |
6I4P-BTB | data/6I/6I4P-BTB/6I4P-BTB_ligand.pdbqt | data/6I/6I4P-BTB/6I4P-BTB_target.pdbqt | data/6I/6I4P-BTB/6I4P-BTB_decoys.pdbqt | data/6I/6I4P-BTB/6I4P-BTB_decoy_scores.csv |
6I1O-BTB | data/6I/6I1O-BTB/6I1O-BTB_ligand.pdbqt | data/6I/6I1O-BTB/6I1O-BTB_target.pdbqt | data/6I/6I1O-BTB/6I1O-BTB_decoys.pdbqt | data/6I/6I1O-BTB/6I1O-BTB_decoy_scores.csv |
6ILI-8DG | data/6I/6ILI-8DG/6ILI-8DG_ligand.pdbqt | data/6I/6ILI-8DG/6ILI-8DG_target.pdbqt | data/6I/6ILI-8DG/6ILI-8DG_decoys.pdbqt | data/6I/6ILI-8DG/6ILI-8DG_decoy_scores.csv |
6I18-H0N | data/6I/6I18-H0N/6I18-H0N_ligand.pdbqt | data/6I/6I18-H0N/6I18-H0N_target.pdbqt | data/6I/6I18-H0N/6I18-H0N_decoys.pdbqt | data/6I/6I18-H0N/6I18-H0N_decoy_scores.csv |
6I8W-11A | data/6I/6I8W-11A/6I8W-11A_ligand.pdbqt | data/6I/6I8W-11A/6I8W-11A_target.pdbqt | data/6I/6I8W-11A/6I8W-11A_decoys.pdbqt | data/6I/6I8W-11A/6I8W-11A_decoy_scores.csv |
6I0P-QAS | data/6I/6I0P-QAS/6I0P-QAS_ligand.pdbqt | data/6I/6I0P-QAS/6I0P-QAS_target.pdbqt | data/6I/6I0P-QAS/6I0P-QAS_decoys.pdbqt | data/6I/6I0P-QAS/6I0P-QAS_decoy_scores.csv |
6IVX-AYO | data/6I/6IVX-AYO/6IVX-AYO_ligand.pdbqt | data/6I/6IVX-AYO/6IVX-AYO_target.pdbqt | data/6I/6IVX-AYO/6IVX-AYO_decoys.pdbqt | data/6I/6IVX-AYO/6IVX-AYO_decoy_scores.csv |
6I4G-ATP | data/6I/6I4G-ATP/6I4G-ATP_ligand.pdbqt | data/6I/6I4G-ATP/6I4G-ATP_target.pdbqt | data/6I/6I4G-ATP/6I4G-ATP_decoys.pdbqt | data/6I/6I4G-ATP/6I4G-ATP_decoy_scores.csv |
6IXM-NAD | data/6I/6IXM-NAD/6IXM-NAD_ligand.pdbqt | data/6I/6IXM-NAD/6IXM-NAD_target.pdbqt | data/6I/6IXM-NAD/6IXM-NAD_decoys.pdbqt | data/6I/6IXM-NAD/6IXM-NAD_decoy_scores.csv |
6IY9-HY0 | data/6I/6IY9-HY0/6IY9-HY0_ligand.pdbqt | data/6I/6IY9-HY0/6IY9-HY0_target.pdbqt | data/6I/6IY9-HY0/6IY9-HY0_decoys.pdbqt | data/6I/6IY9-HY0/6IY9-HY0_decoy_scores.csv |
6I8M-H7W | data/6I/6I8M-H7W/6I8M-H7W_ligand.pdbqt | data/6I/6I8M-H7W/6I8M-H7W_target.pdbqt | data/6I/6I8M-H7W/6I8M-H7W_decoys.pdbqt | data/6I/6I8M-H7W/6I8M-H7W_decoy_scores.csv |
6I95-OCA | data/6I/6I95-OCA/6I95-OCA_ligand.pdbqt | data/6I/6I95-OCA/6I95-OCA_target.pdbqt | data/6I/6I95-OCA/6I95-OCA_decoys.pdbqt | data/6I/6I95-OCA/6I95-OCA_decoy_scores.csv |
6I63-2OH | data/6I/6I63-2OH/6I63-2OH_ligand.pdbqt | data/6I/6I63-2OH/6I63-2OH_target.pdbqt | data/6I/6I63-2OH/6I63-2OH_decoys.pdbqt | data/6I/6I63-2OH/6I63-2OH_decoy_scores.csv |
6II6-GTP | data/6I/6II6-GTP/6II6-GTP_ligand.pdbqt | data/6I/6II6-GTP/6II6-GTP_target.pdbqt | data/6I/6II6-GTP/6II6-GTP_decoys.pdbqt | data/6I/6II6-GTP/6II6-GTP_decoy_scores.csv |
6IC1-AZA | data/6I/6IC1-AZA/6IC1-AZA_ligand.pdbqt | data/6I/6IC1-AZA/6IC1-AZA_target.pdbqt | null | null |
6ILT-ATP | data/6I/6ILT-ATP/6ILT-ATP_ligand.pdbqt | data/6I/6ILT-ATP/6ILT-ATP_target.pdbqt | data/6I/6ILT-ATP/6ILT-ATP_decoys.pdbqt | data/6I/6ILT-ATP/6ILT-ATP_decoy_scores.csv |
6I6N-SAH | data/6I/6I6N-SAH/6I6N-SAH_ligand.pdbqt | data/6I/6I6N-SAH/6I6N-SAH_target.pdbqt | data/6I/6I6N-SAH/6I6N-SAH_decoys.pdbqt | data/6I/6I6N-SAH/6I6N-SAH_decoy_scores.csv |
6I16-H0B | data/6I/6I16-H0B/6I16-H0B_ligand.pdbqt | data/6I/6I16-H0B/6I16-H0B_target.pdbqt | data/6I/6I16-H0B/6I16-H0B_decoys.pdbqt | data/6I/6I16-H0B/6I16-H0B_decoy_scores.csv |
6IJX-JMS | data/6I/6IJX-JMS/6IJX-JMS_ligand.pdbqt | data/6I/6IJX-JMS/6IJX-JMS_target.pdbqt | data/6I/6IJX-JMS/6IJX-JMS_decoys.pdbqt | data/6I/6IJX-JMS/6IJX-JMS_decoy_scores.csv |
6I4H-ATP | data/6I/6I4H-ATP/6I4H-ATP_ligand.pdbqt | data/6I/6I4H-ATP/6I4H-ATP_target.pdbqt | data/6I/6I4H-ATP/6I4H-ATP_decoys.pdbqt | data/6I/6I4H-ATP/6I4H-ATP_decoy_scores.csv |
6IX7-SAH | data/6I/6IX7-SAH/6IX7-SAH_ligand.pdbqt | data/6I/6IX7-SAH/6IX7-SAH_target.pdbqt | data/6I/6IX7-SAH/6IX7-SAH_decoys.pdbqt | data/6I/6IX7-SAH/6IX7-SAH_decoy_scores.csv |
6I76-H5N | data/6I/6I76-H5N/6I76-H5N_ligand.pdbqt | data/6I/6I76-H5N/6I76-H5N_target.pdbqt | data/6I/6I76-H5N/6I76-H5N_decoys.pdbqt | data/6I/6I76-H5N/6I76-H5N_decoy_scores.csv |
6I4E-ADP | data/6I/6I4E-ADP/6I4E-ADP_ligand.pdbqt | data/6I/6I4E-ADP/6I4E-ADP_target.pdbqt | data/6I/6I4E-ADP/6I4E-ADP_decoys.pdbqt | data/6I/6I4E-ADP/6I4E-ADP_decoy_scores.csv |
6IUP-AX0 | data/6I/6IUP-AX0/6IUP-AX0_ligand.pdbqt | data/6I/6IUP-AX0/6IUP-AX0_target.pdbqt | data/6I/6IUP-AX0/6IUP-AX0_decoys.pdbqt | data/6I/6IUP-AX0/6IUP-AX0_decoy_scores.csv |
6IUX-AR6 | data/6I/6IUX-AR6/6IUX-AR6_ligand.pdbqt | data/6I/6IUX-AR6/6IUX-AR6_target.pdbqt | data/6I/6IUX-AR6/6IUX-AR6_decoys.pdbqt | data/6I/6IUX-AR6/6IUX-AR6_decoy_scores.csv |
6IAR-H8W | data/6I/6IAR-H8W/6IAR-H8W_ligand.pdbqt | data/6I/6IAR-H8W/6IAR-H8W_target.pdbqt | data/6I/6IAR-H8W/6IAR-H8W_decoys.pdbqt | data/6I/6IAR-H8W/6IAR-H8W_decoy_scores.csv |
6I0L-GZH | data/6I/6I0L-GZH/6I0L-GZH_ligand.pdbqt | data/6I/6I0L-GZH/6I0L-GZH_target.pdbqt | data/6I/6I0L-GZH/6I0L-GZH_decoys.pdbqt | data/6I/6I0L-GZH/6I0L-GZH_decoy_scores.csv |
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