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 ⌀ |
|---|---|---|---|---|
3QVW-NAD | data/3Q/3QVW-NAD/3QVW-NAD_ligand.pdbqt | data/3Q/3QVW-NAD/3QVW-NAD_target.pdbqt | data/3Q/3QVW-NAD/3QVW-NAD_decoys.pdbqt | data/3Q/3QVW-NAD/3QVW-NAD_decoy_scores.csv |
3Q7U-CTP | data/3Q/3Q7U-CTP/3Q7U-CTP_ligand.pdbqt | data/3Q/3Q7U-CTP/3Q7U-CTP_target.pdbqt | data/3Q/3Q7U-CTP/3Q7U-CTP_decoys.pdbqt | data/3Q/3Q7U-CTP/3Q7U-CTP_decoy_scores.csv |
3QDC-L2P | data/3Q/3QDC-L2P/3QDC-L2P_ligand.pdbqt | data/3Q/3QDC-L2P/3QDC-L2P_target.pdbqt | data/3Q/3QDC-L2P/3QDC-L2P_decoys.pdbqt | data/3Q/3QDC-L2P/3QDC-L2P_decoy_scores.csv |
3QUI-ANP | data/3Q/3QUI-ANP/3QUI-ANP_ligand.pdbqt | data/3Q/3QUI-ANP/3QUI-ANP_target.pdbqt | data/3Q/3QUI-ANP/3QUI-ANP_decoys.pdbqt | data/3Q/3QUI-ANP/3QUI-ANP_decoy_scores.csv |
3QH1-NX6 | data/3Q/3QH1-NX6/3QH1-NX6_ligand.pdbqt | data/3Q/3QH1-NX6/3QH1-NX6_target.pdbqt | data/3Q/3QH1-NX6/3QH1-NX6_decoys.pdbqt | data/3Q/3QH1-NX6/3QH1-NX6_decoy_scores.csv |
3QS3-FLC | data/3Q/3QS3-FLC/3QS3-FLC_ligand.pdbqt | data/3Q/3QS3-FLC/3QS3-FLC_target.pdbqt | data/3Q/3QS3-FLC/3QS3-FLC_decoys.pdbqt | data/3Q/3QS3-FLC/3QS3-FLC_decoy_scores.csv |
3QZQ-AG7 | data/3Q/3QZQ-AG7/3QZQ-AG7_ligand.pdbqt | data/3Q/3QZQ-AG7/3QZQ-AG7_target.pdbqt | data/3Q/3QZQ-AG7/3QZQ-AG7_decoys.pdbqt | data/3Q/3QZQ-AG7/3QZQ-AG7_decoy_scores.csv |
3QSA-TA7 | data/3Q/3QSA-TA7/3QSA-TA7_ligand.pdbqt | data/3Q/3QSA-TA7/3QSA-TA7_target.pdbqt | data/3Q/3QSA-TA7/3QSA-TA7_decoys.pdbqt | data/3Q/3QSA-TA7/3QSA-TA7_decoy_scores.csv |
3Q3H-UDP | data/3Q/3Q3H-UDP/3Q3H-UDP_ligand.pdbqt | data/3Q/3Q3H-UDP/3Q3H-UDP_target.pdbqt | data/3Q/3Q3H-UDP/3Q3H-UDP_decoys.pdbqt | data/3Q/3Q3H-UDP/3Q3H-UDP_decoy_scores.csv |
3QPB-R1P | data/3Q/3QPB-R1P/3QPB-R1P_ligand.pdbqt | data/3Q/3QPB-R1P/3QPB-R1P_target.pdbqt | data/3Q/3QPB-R1P/3QPB-R1P_decoys.pdbqt | data/3Q/3QPB-R1P/3QPB-R1P_decoy_scores.csv |
3Q9X-EMO | data/3Q/3Q9X-EMO/3Q9X-EMO_ligand.pdbqt | data/3Q/3Q9X-EMO/3Q9X-EMO_target.pdbqt | data/3Q/3Q9X-EMO/3Q9X-EMO_decoys.pdbqt | data/3Q/3Q9X-EMO/3Q9X-EMO_decoy_scores.csv |
3QBT-GNP | data/3Q/3QBT-GNP/3QBT-GNP_ligand.pdbqt | data/3Q/3QBT-GNP/3QBT-GNP_target.pdbqt | data/3Q/3QBT-GNP/3QBT-GNP_decoys.pdbqt | data/3Q/3QBT-GNP/3QBT-GNP_decoy_scores.csv |
3QVU-NPO | data/3Q/3QVU-NPO/3QVU-NPO_ligand.pdbqt | data/3Q/3QVU-NPO/3QVU-NPO_target.pdbqt | data/3Q/3QVU-NPO/3QVU-NPO_decoys.pdbqt | data/3Q/3QVU-NPO/3QVU-NPO_decoy_scores.csv |
3Q60-ATP | data/3Q/3Q60-ATP/3Q60-ATP_ligand.pdbqt | data/3Q/3Q60-ATP/3Q60-ATP_target.pdbqt | data/3Q/3Q60-ATP/3Q60-ATP_decoys.pdbqt | data/3Q/3Q60-ATP/3Q60-ATP_decoy_scores.csv |
3Q6J-KPC | data/3Q/3Q6J-KPC/3Q6J-KPC_ligand.pdbqt | data/3Q/3Q6J-KPC/3Q6J-KPC_target.pdbqt | data/3Q/3Q6J-KPC/3Q6J-KPC_decoys.pdbqt | data/3Q/3Q6J-KPC/3Q6J-KPC_decoy_scores.csv |
3QVQ-G3P | data/3Q/3QVQ-G3P/3QVQ-G3P_ligand.pdbqt | data/3Q/3QVQ-G3P/3QVQ-G3P_target.pdbqt | data/3Q/3QVQ-G3P/3QVQ-G3P_decoys.pdbqt | data/3Q/3QVQ-G3P/3QVQ-G3P_decoy_scores.csv |
3QYL-7ME | data/3Q/3QYL-7ME/3QYL-7ME_ligand.pdbqt | data/3Q/3QYL-7ME/3QYL-7ME_target.pdbqt | data/3Q/3QYL-7ME/3QYL-7ME_decoys.pdbqt | data/3Q/3QYL-7ME/3QYL-7ME_decoy_scores.csv |
3Q72-GNP | data/3Q/3Q72-GNP/3Q72-GNP_ligand.pdbqt | data/3Q/3Q72-GNP/3Q72-GNP_target.pdbqt | data/3Q/3Q72-GNP/3Q72-GNP_decoys.pdbqt | data/3Q/3Q72-GNP/3Q72-GNP_decoy_scores.csv |
3QBW-ADP | data/3Q/3QBW-ADP/3QBW-ADP_ligand.pdbqt | data/3Q/3QBW-ADP/3QBW-ADP_target.pdbqt | data/3Q/3QBW-ADP/3QBW-ADP_decoys.pdbqt | data/3Q/3QBW-ADP/3QBW-ADP_decoy_scores.csv |
3QCZ-GLU | data/3Q/3QCZ-GLU/3QCZ-GLU_ligand.pdbqt | data/3Q/3QCZ-GLU/3QCZ-GLU_target.pdbqt | data/3Q/3QCZ-GLU/3QCZ-GLU_decoys.pdbqt | data/3Q/3QCZ-GLU/3QCZ-GLU_decoy_scores.csv |
3Q3N-NPO | data/3Q/3Q3N-NPO/3Q3N-NPO_ligand.pdbqt | data/3Q/3Q3N-NPO/3Q3N-NPO_target.pdbqt | data/3Q/3Q3N-NPO/3Q3N-NPO_decoys.pdbqt | data/3Q/3Q3N-NPO/3Q3N-NPO_decoy_scores.csv |
3QUP-LUN | data/3Q/3QUP-LUN/3QUP-LUN_ligand.pdbqt | data/3Q/3QUP-LUN/3QUP-LUN_target.pdbqt | data/3Q/3QUP-LUN/3QUP-LUN_decoys.pdbqt | data/3Q/3QUP-LUN/3QUP-LUN_decoy_scores.csv |
3QVU-A3P | data/3Q/3QVU-A3P/3QVU-A3P_ligand.pdbqt | data/3Q/3QVU-A3P/3QVU-A3P_target.pdbqt | data/3Q/3QVU-A3P/3QVU-A3P_decoys.pdbqt | data/3Q/3QVU-A3P/3QVU-A3P_decoy_scores.csv |
3QT0-486 | data/3Q/3QT0-486/3QT0-486_ligand.pdbqt | data/3Q/3QT0-486/3QT0-486_target.pdbqt | data/3Q/3QT0-486/3QT0-486_decoys.pdbqt | data/3Q/3QT0-486/3QT0-486_decoy_scores.csv |
3QGO-0A9 | data/3Q/3QGO-0A9/3QGO-0A9_ligand.pdbqt | data/3Q/3QGO-0A9/3QGO-0A9_target.pdbqt | data/3Q/3QGO-0A9/3QGO-0A9_decoys.pdbqt | data/3Q/3QGO-0A9/3QGO-0A9_decoy_scores.csv |
3Q94-13P | data/3Q/3Q94-13P/3Q94-13P_ligand.pdbqt | data/3Q/3Q94-13P/3Q94-13P_target.pdbqt | data/3Q/3Q94-13P/3Q94-13P_decoys.pdbqt | data/3Q/3Q94-13P/3Q94-13P_decoy_scores.csv |
3QSA-PRP | data/3Q/3QSA-PRP/3QSA-PRP_ligand.pdbqt | data/3Q/3QSA-PRP/3QSA-PRP_target.pdbqt | data/3Q/3QSA-PRP/3QSA-PRP_decoys.pdbqt | data/3Q/3QSA-PRP/3QSA-PRP_decoy_scores.csv |
3QVX-NAD | data/3Q/3QVX-NAD/3QVX-NAD_ligand.pdbqt | data/3Q/3QVX-NAD/3QVX-NAD_target.pdbqt | data/3Q/3QVX-NAD/3QVX-NAD_decoys.pdbqt | data/3Q/3QVX-NAD/3QVX-NAD_decoy_scores.csv |
3QF7-ANP | data/3Q/3QF7-ANP/3QF7-ANP_ligand.pdbqt | data/3Q/3QF7-ANP/3QF7-ANP_target.pdbqt | data/3Q/3QF7-ANP/3QF7-ANP_decoys.pdbqt | data/3Q/3QF7-ANP/3QF7-ANP_decoy_scores.csv |
3QKW-UDP | data/3Q/3QKW-UDP/3QKW-UDP_ligand.pdbqt | data/3Q/3QKW-UDP/3QKW-UDP_target.pdbqt | data/3Q/3QKW-UDP/3QKW-UDP_decoys.pdbqt | data/3Q/3QKW-UDP/3QKW-UDP_decoy_scores.csv |
3Q8U-ADP | data/3Q/3Q8U-ADP/3Q8U-ADP_ligand.pdbqt | data/3Q/3Q8U-ADP/3Q8U-ADP_target.pdbqt | data/3Q/3Q8U-ADP/3Q8U-ADP_decoys.pdbqt | data/3Q/3Q8U-ADP/3Q8U-ADP_decoy_scores.csv |
3Q9F-CXS | data/3Q/3Q9F-CXS/3Q9F-CXS_ligand.pdbqt | data/3Q/3Q9F-CXS/3Q9F-CXS_target.pdbqt | data/3Q/3Q9F-CXS/3Q9F-CXS_decoys.pdbqt | data/3Q/3Q9F-CXS/3Q9F-CXS_decoy_scores.csv |
3QUN-ATP | data/3Q/3QUN-ATP/3QUN-ATP_ligand.pdbqt | data/3Q/3QUN-ATP/3QUN-ATP_target.pdbqt | data/3Q/3QUN-ATP/3QUN-ATP_decoys.pdbqt | data/3Q/3QUN-ATP/3QUN-ATP_decoy_scores.csv |
3QN8-NI7 | data/3Q/3QN8-NI7/3QN8-NI7_ligand.pdbqt | data/3Q/3QN8-NI7/3QN8-NI7_target.pdbqt | data/3Q/3QN8-NI7/3QN8-NI7_decoys.pdbqt | data/3Q/3QN8-NI7/3QN8-NI7_decoy_scores.csv |
3QXJ-GTP | data/3Q/3QXJ-GTP/3QXJ-GTP_ligand.pdbqt | data/3Q/3QXJ-GTP/3QXJ-GTP_target.pdbqt | data/3Q/3QXJ-GTP/3QXJ-GTP_decoys.pdbqt | data/3Q/3QXJ-GTP/3QXJ-GTP_decoy_scores.csv |
3QCH-NX2 | data/3Q/3QCH-NX2/3QCH-NX2_ligand.pdbqt | data/3Q/3QCH-NX2/3QCH-NX2_target.pdbqt | data/3Q/3QCH-NX2/3QCH-NX2_decoys.pdbqt | data/3Q/3QCH-NX2/3QCH-NX2_decoy_scores.csv |
3Q3K-D90 | data/3Q/3Q3K-D90/3Q3K-D90_ligand.pdbqt | data/3Q/3Q3K-D90/3Q3K-D90_target.pdbqt | data/3Q/3Q3K-D90/3Q3K-D90_decoys.pdbqt | data/3Q/3Q3K-D90/3Q3K-D90_decoy_scores.csv |
3QF0-BMP | data/3Q/3QF0-BMP/3QF0-BMP_ligand.pdbqt | data/3Q/3QF0-BMP/3QF0-BMP_target.pdbqt | data/3Q/3QF0-BMP/3QF0-BMP_decoys.pdbqt | data/3Q/3QF0-BMP/3QF0-BMP_decoy_scores.csv |
3QXX-8AC | data/3Q/3QXX-8AC/3QXX-8AC_ligand.pdbqt | data/3Q/3QXX-8AC/3QXX-8AC_target.pdbqt | data/3Q/3QXX-8AC/3QXX-8AC_decoys.pdbqt | data/3Q/3QXX-8AC/3QXX-8AC_decoy_scores.csv |
3QCY-3Q3 | data/3Q/3QCY-3Q3/3QCY-3Q3_ligand.pdbqt | data/3Q/3QCY-3Q3/3QCY-3Q3_target.pdbqt | data/3Q/3QCY-3Q3/3QCY-3Q3_decoys.pdbqt | data/3Q/3QCY-3Q3/3QCY-3Q3_decoy_scores.csv |
3QRM-NK7 | data/3Q/3QRM-NK7/3QRM-NK7_ligand.pdbqt | data/3Q/3QRM-NK7/3QRM-NK7_target.pdbqt | data/3Q/3QRM-NK7/3QRM-NK7_decoys.pdbqt | data/3Q/3QRM-NK7/3QRM-NK7_decoy_scores.csv |
3QN7-ZBR | data/3Q/3QN7-ZBR/3QN7-ZBR_ligand.pdbqt | data/3Q/3QN7-ZBR/3QN7-ZBR_target.pdbqt | data/3Q/3QN7-ZBR/3QN7-ZBR_decoys.pdbqt | data/3Q/3QN7-ZBR/3QN7-ZBR_decoy_scores.csv |
3QOP-CMP | data/3Q/3QOP-CMP/3QOP-CMP_ligand.pdbqt | data/3Q/3QOP-CMP/3QOP-CMP_target.pdbqt | data/3Q/3QOP-CMP/3QOP-CMP_decoys.pdbqt | data/3Q/3QOP-CMP/3QOP-CMP_decoy_scores.csv |
3Q2D-3NY | data/3Q/3Q2D-3NY/3Q2D-3NY_ligand.pdbqt | data/3Q/3Q2D-3NY/3Q2D-3NY_target.pdbqt | data/3Q/3Q2D-3NY/3Q2D-3NY_decoys.pdbqt | data/3Q/3Q2D-3NY/3Q2D-3NY_decoy_scores.csv |
3QPP-PFW | data/3Q/3QPP-PFW/3QPP-PFW_ligand.pdbqt | data/3Q/3QPP-PFW/3QPP-PFW_target.pdbqt | data/3Q/3QPP-PFW/3QPP-PFW_decoys.pdbqt | data/3Q/3QPP-PFW/3QPP-PFW_decoy_scores.csv |
3QNL-ROA | data/3Q/3QNL-ROA/3QNL-ROA_ligand.pdbqt | data/3Q/3QNL-ROA/3QNL-ROA_target.pdbqt | data/3Q/3QNL-ROA/3QNL-ROA_decoys.pdbqt | data/3Q/3QNL-ROA/3QNL-ROA_decoy_scores.csv |
3QBF-JHG | data/3Q/3QBF-JHG/3QBF-JHG_ligand.pdbqt | data/3Q/3QBF-JHG/3QBF-JHG_target.pdbqt | data/3Q/3QBF-JHG/3QBF-JHG_decoys.pdbqt | data/3Q/3QBF-JHG/3QBF-JHG_decoy_scores.csv |
3Q53-ATP | data/3Q/3Q53-ATP/3Q53-ATP_ligand.pdbqt | data/3Q/3Q53-ATP/3Q53-ATP_target.pdbqt | data/3Q/3Q53-ATP/3Q53-ATP_decoys.pdbqt | data/3Q/3Q53-ATP/3Q53-ATP_decoy_scores.csv |
3QFR-FMN | data/3Q/3QFR-FMN/3QFR-FMN_ligand.pdbqt | data/3Q/3QFR-FMN/3QFR-FMN_target.pdbqt | data/3Q/3QFR-FMN/3QFR-FMN_decoys.pdbqt | data/3Q/3QFR-FMN/3QFR-FMN_decoy_scores.csv |
3QIH-NI7 | data/3Q/3QIH-NI7/3QIH-NI7_ligand.pdbqt | data/3Q/3QIH-NI7/3QIH-NI7_target.pdbqt | data/3Q/3QIH-NI7/3QIH-NI7_decoys.pdbqt | data/3Q/3QIH-NI7/3QIH-NI7_decoy_scores.csv |
3QJ0-QI3 | data/3Q/3QJ0-QI3/3QJ0-QI3_ligand.pdbqt | data/3Q/3QJ0-QI3/3QJ0-QI3_target.pdbqt | data/3Q/3QJ0-QI3/3QJ0-QI3_decoys.pdbqt | data/3Q/3QJ0-QI3/3QJ0-QI3_decoy_scores.csv |
3QPW-PEP | data/3Q/3QPW-PEP/3QPW-PEP_ligand.pdbqt | data/3Q/3QPW-PEP/3QPW-PEP_target.pdbqt | null | null |
3QHD-CTN | data/3Q/3QHD-CTN/3QHD-CTN_ligand.pdbqt | data/3Q/3QHD-CTN/3QHD-CTN_target.pdbqt | data/3Q/3QHD-CTN/3QHD-CTN_decoys.pdbqt | data/3Q/3QHD-CTN/3QHD-CTN_decoy_scores.csv |
3QTP-2PG | data/3Q/3QTP-2PG/3QTP-2PG_ligand.pdbqt | data/3Q/3QTP-2PG/3QTP-2PG_target.pdbqt | data/3Q/3QTP-2PG/3QTP-2PG_decoys.pdbqt | data/3Q/3QTP-2PG/3QTP-2PG_decoy_scores.csv |
3Q9C-Q9C | data/3Q/3Q9C-Q9C/3Q9C-Q9C_ligand.pdbqt | data/3Q/3Q9C-Q9C/3Q9C-Q9C_target.pdbqt | data/3Q/3Q9C-Q9C/3Q9C-Q9C_decoys.pdbqt | data/3Q/3Q9C-Q9C/3Q9C-Q9C_decoy_scores.csv |
3QE2-FMN | data/3Q/3QE2-FMN/3QE2-FMN_ligand.pdbqt | data/3Q/3QE2-FMN/3QE2-FMN_target.pdbqt | data/3Q/3QE2-FMN/3QE2-FMN_decoys.pdbqt | data/3Q/3QE2-FMN/3QE2-FMN_decoy_scores.csv |
3QBI-RET | data/3Q/3QBI-RET/3QBI-RET_ligand.pdbqt | data/3Q/3QBI-RET/3QBI-RET_target.pdbqt | data/3Q/3QBI-RET/3QBI-RET_decoys.pdbqt | data/3Q/3QBI-RET/3QBI-RET_decoy_scores.csv |
3Q4B-RX5 | data/3Q/3Q4B-RX5/3Q4B-RX5_ligand.pdbqt | data/3Q/3Q4B-RX5/3Q4B-RX5_target.pdbqt | data/3Q/3Q4B-RX5/3Q4B-RX5_decoys.pdbqt | data/3Q/3Q4B-RX5/3Q4B-RX5_decoy_scores.csv |
3QNL-P33 | data/3Q/3QNL-P33/3QNL-P33_ligand.pdbqt | data/3Q/3QNL-P33/3QNL-P33_target.pdbqt | data/3Q/3QNL-P33/3QNL-P33_decoys.pdbqt | data/3Q/3QNL-P33/3QNL-P33_decoy_scores.csv |
3QRK-9DP | data/3Q/3QRK-9DP/3QRK-9DP_ligand.pdbqt | data/3Q/3QRK-9DP/3QRK-9DP_target.pdbqt | data/3Q/3QRK-9DP/3QRK-9DP_decoys.pdbqt | data/3Q/3QRK-9DP/3QRK-9DP_decoy_scores.csv |
3QDW-NDG | data/3Q/3QDW-NDG/3QDW-NDG_ligand.pdbqt | data/3Q/3QDW-NDG/3QDW-NDG_target.pdbqt | data/3Q/3QDW-NDG/3QDW-NDG_decoys.pdbqt | data/3Q/3QDW-NDG/3QDW-NDG_decoy_scores.csv |
3QRT-X14 | data/3Q/3QRT-X14/3QRT-X14_ligand.pdbqt | data/3Q/3QRT-X14/3QRT-X14_target.pdbqt | data/3Q/3QRT-X14/3QRT-X14_decoys.pdbqt | data/3Q/3QRT-X14/3QRT-X14_decoy_scores.csv |
3Q2I-NAI | data/3Q/3Q2I-NAI/3Q2I-NAI_ligand.pdbqt | data/3Q/3Q2I-NAI/3Q2I-NAI_target.pdbqt | data/3Q/3Q2I-NAI/3Q2I-NAI_decoys.pdbqt | data/3Q/3Q2I-NAI/3Q2I-NAI_decoy_scores.csv |
3QD4-3Q6 | data/3Q/3QD4-3Q6/3QD4-3Q6_ligand.pdbqt | data/3Q/3QD4-3Q6/3QD4-3Q6_target.pdbqt | data/3Q/3QD4-3Q6/3QD4-3Q6_decoys.pdbqt | data/3Q/3QD4-3Q6/3QD4-3Q6_decoy_scores.csv |
3QFX-CP6 | data/3Q/3QFX-CP6/3QFX-CP6_ligand.pdbqt | data/3Q/3QFX-CP6/3QFX-CP6_target.pdbqt | data/3Q/3QFX-CP6/3QFX-CP6_decoys.pdbqt | data/3Q/3QFX-CP6/3QFX-CP6_decoy_scores.csv |
3QJG-FMN | data/3Q/3QJG-FMN/3QJG-FMN_ligand.pdbqt | data/3Q/3QJG-FMN/3QJG-FMN_target.pdbqt | data/3Q/3QJG-FMN/3QJG-FMN_decoys.pdbqt | data/3Q/3QJG-FMN/3QJG-FMN_decoy_scores.csv |
3QYY-C2E | data/3Q/3QYY-C2E/3QYY-C2E_ligand.pdbqt | data/3Q/3QYY-C2E/3QYY-C2E_target.pdbqt | data/3Q/3QYY-C2E/3QYY-C2E_decoys.pdbqt | data/3Q/3QYY-C2E/3QYY-C2E_decoy_scores.csv |
3QWI-CUE | data/3Q/3QWI-CUE/3QWI-CUE_ligand.pdbqt | data/3Q/3QWI-CUE/3QWI-CUE_target.pdbqt | data/3Q/3QWI-CUE/3QWI-CUE_decoys.pdbqt | data/3Q/3QWI-CUE/3QWI-CUE_decoy_scores.csv |
3QBD-NAD | data/3Q/3QBD-NAD/3QBD-NAD_ligand.pdbqt | data/3Q/3QBD-NAD/3QBD-NAD_target.pdbqt | data/3Q/3QBD-NAD/3QBD-NAD_decoys.pdbqt | data/3Q/3QBD-NAD/3QBD-NAD_decoy_scores.csv |
3QLM-PLM | data/3Q/3QLM-PLM/3QLM-PLM_ligand.pdbqt | data/3Q/3QLM-PLM/3QLM-PLM_target.pdbqt | data/3Q/3QLM-PLM/3QLM-PLM_decoys.pdbqt | data/3Q/3QLM-PLM/3QLM-PLM_decoy_scores.csv |
3Q7D-NPX | data/3Q/3Q7D-NPX/3Q7D-NPX_ligand.pdbqt | data/3Q/3Q7D-NPX/3Q7D-NPX_target.pdbqt | data/3Q/3Q7D-NPX/3Q7D-NPX_decoys.pdbqt | data/3Q/3Q7D-NPX/3Q7D-NPX_decoy_scores.csv |
3Q0W-LL5 | data/3Q/3Q0W-LL5/3Q0W-LL5_ligand.pdbqt | data/3Q/3Q0W-LL5/3Q0W-LL5_target.pdbqt | data/3Q/3Q0W-LL5/3Q0W-LL5_decoys.pdbqt | data/3Q/3Q0W-LL5/3Q0W-LL5_decoy_scores.csv |
3QHD-795 | data/3Q/3QHD-795/3QHD-795_ligand.pdbqt | data/3Q/3QHD-795/3QHD-795_target.pdbqt | data/3Q/3QHD-795/3QHD-795_decoys.pdbqt | data/3Q/3QHD-795/3QHD-795_decoy_scores.csv |
3Q0V-LL4 | data/3Q/3Q0V-LL4/3Q0V-LL4_ligand.pdbqt | data/3Q/3Q0V-LL4/3Q0V-LL4_target.pdbqt | data/3Q/3Q0V-LL4/3Q0V-LL4_decoys.pdbqt | data/3Q/3Q0V-LL4/3Q0V-LL4_decoy_scores.csv |
3Q07-WPP | data/3Q/3Q07-WPP/3Q07-WPP_ligand.pdbqt | data/3Q/3Q07-WPP/3Q07-WPP_target.pdbqt | data/3Q/3Q07-WPP/3Q07-WPP_decoys.pdbqt | data/3Q/3Q07-WPP/3Q07-WPP_decoy_scores.csv |
3QVB-UDP | data/3Q/3QVB-UDP/3QVB-UDP_ligand.pdbqt | data/3Q/3QVB-UDP/3QVB-UDP_target.pdbqt | data/3Q/3QVB-UDP/3QVB-UDP_decoys.pdbqt | data/3Q/3QVB-UDP/3QVB-UDP_decoy_scores.csv |
3QIO-QID | data/3Q/3QIO-QID/3QIO-QID_ligand.pdbqt | data/3Q/3QIO-QID/3QIO-QID_target.pdbqt | data/3Q/3QIO-QID/3QIO-QID_decoys.pdbqt | data/3Q/3QIO-QID/3QIO-QID_decoy_scores.csv |
3QWV-SAH | data/3Q/3QWV-SAH/3QWV-SAH_ligand.pdbqt | data/3Q/3QWV-SAH/3QWV-SAH_target.pdbqt | data/3Q/3QWV-SAH/3QWV-SAH_decoys.pdbqt | data/3Q/3QWV-SAH/3QWV-SAH_decoy_scores.csv |
3QIZ-QI2 | data/3Q/3QIZ-QI2/3QIZ-QI2_ligand.pdbqt | data/3Q/3QIZ-QI2/3QIZ-QI2_target.pdbqt | data/3Q/3QIZ-QI2/3QIZ-QI2_decoys.pdbqt | data/3Q/3QIZ-QI2/3QIZ-QI2_decoy_scores.csv |
3QLS-55V | data/3Q/3QLS-55V/3QLS-55V_ligand.pdbqt | data/3Q/3QLS-55V/3QLS-55V_target.pdbqt | data/3Q/3QLS-55V/3QLS-55V_decoys.pdbqt | data/3Q/3QLS-55V/3QLS-55V_decoy_scores.csv |
3Q11-P4F | data/3Q/3Q11-P4F/3Q11-P4F_ligand.pdbqt | data/3Q/3Q11-P4F/3Q11-P4F_target.pdbqt | data/3Q/3Q11-P4F/3Q11-P4F_decoys.pdbqt | data/3Q/3Q11-P4F/3Q11-P4F_decoy_scores.csv |
3QOL-THP | data/3Q/3QOL-THP/3QOL-THP_ligand.pdbqt | data/3Q/3QOL-THP/3QOL-THP_target.pdbqt | data/3Q/3QOL-THP/3QOL-THP_decoys.pdbqt | data/3Q/3QOL-THP/3QOL-THP_decoy_scores.csv |
3QVS-NAD | data/3Q/3QVS-NAD/3QVS-NAD_ligand.pdbqt | data/3Q/3QVS-NAD/3QVS-NAD_target.pdbqt | data/3Q/3QVS-NAD/3QVS-NAD_decoys.pdbqt | data/3Q/3QVS-NAD/3QVS-NAD_decoy_scores.csv |
3QUI-ADP | data/3Q/3QUI-ADP/3QUI-ADP_ligand.pdbqt | data/3Q/3QUI-ADP/3QUI-ADP_target.pdbqt | data/3Q/3QUI-ADP/3QUI-ADP_decoys.pdbqt | data/3Q/3QUI-ADP/3QUI-ADP_decoy_scores.csv |
3QDV-NDG | data/3Q/3QDV-NDG/3QDV-NDG_ligand.pdbqt | data/3Q/3QDV-NDG/3QDV-NDG_target.pdbqt | data/3Q/3QDV-NDG/3QDV-NDG_decoys.pdbqt | data/3Q/3QDV-NDG/3QDV-NDG_decoy_scores.csv |
3QZG-X67 | data/3Q/3QZG-X67/3QZG-X67_ligand.pdbqt | data/3Q/3QZG-X67/3QZG-X67_target.pdbqt | data/3Q/3QZG-X67/3QZG-X67_decoys.pdbqt | data/3Q/3QZG-X67/3QZG-X67_decoy_scores.csv |
3QCJ-NX4 | data/3Q/3QCJ-NX4/3QCJ-NX4_ligand.pdbqt | data/3Q/3QCJ-NX4/3QCJ-NX4_target.pdbqt | data/3Q/3QCJ-NX4/3QCJ-NX4_decoys.pdbqt | data/3Q/3QCJ-NX4/3QCJ-NX4_decoy_scores.csv |
3QPV-ADP | data/3Q/3QPV-ADP/3QPV-ADP_ligand.pdbqt | data/3Q/3QPV-ADP/3QPV-ADP_target.pdbqt | data/3Q/3QPV-ADP/3QPV-ADP_decoys.pdbqt | data/3Q/3QPV-ADP/3QPV-ADP_decoy_scores.csv |
3QPS-CHD | data/3Q/3QPS-CHD/3QPS-CHD_ligand.pdbqt | data/3Q/3QPS-CHD/3QPS-CHD_target.pdbqt | data/3Q/3QPS-CHD/3QPS-CHD_decoys.pdbqt | data/3Q/3QPS-CHD/3QPS-CHD_decoy_scores.csv |
3QGY-PQC | data/3Q/3QGY-PQC/3QGY-PQC_ligand.pdbqt | data/3Q/3QGY-PQC/3QGY-PQC_target.pdbqt | data/3Q/3QGY-PQC/3QGY-PQC_decoys.pdbqt | data/3Q/3QGY-PQC/3QGY-PQC_decoy_scores.csv |
3QQS-PRP | data/3Q/3QQS-PRP/3QQS-PRP_ligand.pdbqt | data/3Q/3QQS-PRP/3QQS-PRP_target.pdbqt | data/3Q/3QQS-PRP/3QQS-PRP_decoys.pdbqt | data/3Q/3QQS-PRP/3QQS-PRP_decoy_scores.csv |
3QI3-PDB | data/3Q/3QI3-PDB/3QI3-PDB_ligand.pdbqt | data/3Q/3QI3-PDB/3QI3-PDB_target.pdbqt | data/3Q/3QI3-PDB/3QI3-PDB_decoys.pdbqt | data/3Q/3QI3-PDB/3QI3-PDB_decoy_scores.csv |
3QZF-X66 | data/3Q/3QZF-X66/3QZF-X66_ligand.pdbqt | data/3Q/3QZF-X66/3QZF-X66_target.pdbqt | data/3Q/3QZF-X66/3QZF-X66_decoys.pdbqt | data/3Q/3QZF-X66/3QZF-X66_decoy_scores.csv |
3Q9E-SP5 | data/3Q/3Q9E-SP5/3Q9E-SP5_ligand.pdbqt | data/3Q/3Q9E-SP5/3Q9E-SP5_target.pdbqt | data/3Q/3Q9E-SP5/3Q9E-SP5_decoys.pdbqt | data/3Q/3Q9E-SP5/3Q9E-SP5_decoy_scores.csv |
3QM1-ZYC | data/3Q/3QM1-ZYC/3QM1-ZYC_ligand.pdbqt | data/3Q/3QM1-ZYC/3QM1-ZYC_target.pdbqt | data/3Q/3QM1-ZYC/3QM1-ZYC_decoys.pdbqt | data/3Q/3QM1-ZYC/3QM1-ZYC_decoy_scores.csv |
3QIH-FG7 | data/3Q/3QIH-FG7/3QIH-FG7_ligand.pdbqt | data/3Q/3QIH-FG7/3QIH-FG7_target.pdbqt | data/3Q/3QIH-FG7/3QIH-FG7_decoys.pdbqt | data/3Q/3QIH-FG7/3QIH-FG7_decoy_scores.csv |
3QP0-NI8 | data/3Q/3QP0-NI8/3QP0-NI8_ligand.pdbqt | data/3Q/3QP0-NI8/3QP0-NI8_target.pdbqt | data/3Q/3QP0-NI8/3QP0-NI8_decoys.pdbqt | data/3Q/3QP0-NI8/3QP0-NI8_decoy_scores.csv |
3QEZ-BMP | data/3Q/3QEZ-BMP/3QEZ-BMP_ligand.pdbqt | data/3Q/3QEZ-BMP/3QEZ-BMP_target.pdbqt | data/3Q/3QEZ-BMP/3QEZ-BMP_decoys.pdbqt | data/3Q/3QEZ-BMP/3QEZ-BMP_decoy_scores.csv |
3QDV-A2G | data/3Q/3QDV-A2G/3QDV-A2G_ligand.pdbqt | data/3Q/3QDV-A2G/3QDV-A2G_target.pdbqt | data/3Q/3QDV-A2G/3QDV-A2G_decoys.pdbqt | data/3Q/3QDV-A2G/3QDV-A2G_decoy_scores.csv |
3QKM-SM9 | data/3Q/3QKM-SM9/3QKM-SM9_ligand.pdbqt | data/3Q/3QKM-SM9/3QKM-SM9_target.pdbqt | data/3Q/3QKM-SM9/3QKM-SM9_decoys.pdbqt | data/3Q/3QKM-SM9/3QKM-SM9_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.