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 ⌀ |
|---|---|---|---|---|
5TN5-7G0 | data/5T/5TN5-7G0/5TN5-7G0_ligand.pdbqt | data/5T/5TN5-7G0/5TN5-7G0_target.pdbqt | data/5T/5TN5-7G0/5TN5-7G0_decoys.pdbqt | data/5T/5TN5-7G0/5TN5-7G0_decoy_scores.csv |
5T1Z-Q97 | data/5T/5T1Z-Q97/5T1Z-Q97_ligand.pdbqt | data/5T/5T1Z-Q97/5T1Z-Q97_target.pdbqt | data/5T/5T1Z-Q97/5T1Z-Q97_decoys.pdbqt | data/5T/5T1Z-Q97/5T1Z-Q97_decoy_scores.csv |
5TE1-7A2 | data/5T/5TE1-7A2/5TE1-7A2_ligand.pdbqt | data/5T/5TE1-7A2/5TE1-7A2_target.pdbqt | data/5T/5TE1-7A2/5TE1-7A2_decoys.pdbqt | data/5T/5TE1-7A2/5TE1-7A2_decoy_scores.csv |
5TI2-7CJ | data/5T/5TI2-7CJ/5TI2-7CJ_ligand.pdbqt | data/5T/5TI2-7CJ/5TI2-7CJ_target.pdbqt | data/5T/5TI2-7CJ/5TI2-7CJ_decoys.pdbqt | data/5T/5TI2-7CJ/5TI2-7CJ_decoy_scores.csv |
5T2T-0N8 | data/5T/5T2T-0N8/5T2T-0N8_ligand.pdbqt | data/5T/5T2T-0N8/5T2T-0N8_target.pdbqt | data/5T/5T2T-0N8/5T2T-0N8_decoys.pdbqt | data/5T/5T2T-0N8/5T2T-0N8_decoy_scores.csv |
5TAI-LYS | data/5T/5TAI-LYS/5TAI-LYS_ligand.pdbqt | data/5T/5TAI-LYS/5TAI-LYS_target.pdbqt | data/5T/5TAI-LYS/5TAI-LYS_decoys.pdbqt | data/5T/5TAI-LYS/5TAI-LYS_decoy_scores.csv |
5T7M-TRP | data/5T/5T7M-TRP/5T7M-TRP_ligand.pdbqt | data/5T/5T7M-TRP/5T7M-TRP_target.pdbqt | data/5T/5T7M-TRP/5T7M-TRP_decoys.pdbqt | data/5T/5T7M-TRP/5T7M-TRP_decoy_scores.csv |
5T2Y-753 | data/5T/5T2Y-753/5T2Y-753_ligand.pdbqt | data/5T/5T2Y-753/5T2Y-753_target.pdbqt | data/5T/5T2Y-753/5T2Y-753_decoys.pdbqt | data/5T/5T2Y-753/5T2Y-753_decoy_scores.csv |
5TTG-7KZ | data/5T/5TTG-7KZ/5TTG-7KZ_ligand.pdbqt | data/5T/5TTG-7KZ/5TTG-7KZ_target.pdbqt | data/5T/5TTG-7KZ/5TTG-7KZ_decoys.pdbqt | data/5T/5TTG-7KZ/5TTG-7KZ_decoy_scores.csv |
5TDF-ADP | data/5T/5TDF-ADP/5TDF-ADP_ligand.pdbqt | data/5T/5TDF-ADP/5TDF-ADP_target.pdbqt | data/5T/5TDF-ADP/5TDF-ADP_decoys.pdbqt | data/5T/5TDF-ADP/5TDF-ADP_decoy_scores.csv |
5TDZ-ADN | data/5T/5TDZ-ADN/5TDZ-ADN_ligand.pdbqt | data/5T/5TDZ-ADN/5TDZ-ADN_target.pdbqt | data/5T/5TDZ-ADN/5TDZ-ADN_decoys.pdbqt | data/5T/5TDZ-ADN/5TDZ-ADN_decoy_scores.csv |
5TYA-7QS | data/5T/5TYA-7QS/5TYA-7QS_ligand.pdbqt | data/5T/5TYA-7QS/5TYA-7QS_target.pdbqt | data/5T/5TYA-7QS/5TYA-7QS_decoys.pdbqt | data/5T/5TYA-7QS/5TYA-7QS_decoy_scores.csv |
5TIE-OCA | data/5T/5TIE-OCA/5TIE-OCA_ligand.pdbqt | data/5T/5TIE-OCA/5TIE-OCA_target.pdbqt | data/5T/5TIE-OCA/5TIE-OCA_decoys.pdbqt | data/5T/5TIE-OCA/5TIE-OCA_decoy_scores.csv |
5TNK-7F2 | data/5T/5TNK-7F2/5TNK-7F2_ligand.pdbqt | data/5T/5TNK-7F2/5TNK-7F2_target.pdbqt | data/5T/5TNK-7F2/5TNK-7F2_decoys.pdbqt | data/5T/5TNK-7F2/5TNK-7F2_decoy_scores.csv |
5T71-75W | data/5T/5T71-75W/5T71-75W_ligand.pdbqt | data/5T/5T71-75W/5T71-75W_target.pdbqt | data/5T/5T71-75W/5T71-75W_decoys.pdbqt | data/5T/5T71-75W/5T71-75W_decoy_scores.csv |
5TRK-7HH | data/5T/5TRK-7HH/5TRK-7HH_ligand.pdbqt | data/5T/5TRK-7HH/5TRK-7HH_target.pdbqt | data/5T/5TRK-7HH/5TRK-7HH_decoys.pdbqt | data/5T/5TRK-7HH/5TRK-7HH_decoy_scores.csv |
5T6B-SAH | data/5T/5T6B-SAH/5T6B-SAH_ligand.pdbqt | data/5T/5T6B-SAH/5T6B-SAH_target.pdbqt | data/5T/5T6B-SAH/5T6B-SAH_decoys.pdbqt | data/5T/5T6B-SAH/5T6B-SAH_decoy_scores.csv |
5TPU-TYD | data/5T/5TPU-TYD/5TPU-TYD_ligand.pdbqt | data/5T/5TPU-TYD/5TPU-TYD_target.pdbqt | data/5T/5TPU-TYD/5TPU-TYD_decoys.pdbqt | data/5T/5TPU-TYD/5TPU-TYD_decoy_scores.csv |
5TNT-7GQ | data/5T/5TNT-7GQ/5TNT-7GQ_ligand.pdbqt | data/5T/5TNT-7GQ/5TNT-7GQ_target.pdbqt | data/5T/5TNT-7GQ/5TNT-7GQ_decoys.pdbqt | data/5T/5TNT-7GQ/5TNT-7GQ_decoy_scores.csv |
5T9W-78E | data/5T/5T9W-78E/5T9W-78E_ligand.pdbqt | data/5T/5T9W-78E/5T9W-78E_target.pdbqt | data/5T/5T9W-78E/5T9W-78E_decoys.pdbqt | data/5T/5T9W-78E/5T9W-78E_decoy_scores.csv |
5TBO-LDA | data/5T/5TBO-LDA/5TBO-LDA_ligand.pdbqt | data/5T/5TBO-LDA/5TBO-LDA_target.pdbqt | data/5T/5TBO-LDA/5TBO-LDA_decoys.pdbqt | data/5T/5TBO-LDA/5TBO-LDA_decoy_scores.csv |
5TBO-ORO | data/5T/5TBO-ORO/5TBO-ORO_ligand.pdbqt | data/5T/5TBO-ORO/5TBO-ORO_target.pdbqt | data/5T/5TBO-ORO/5TBO-ORO_decoys.pdbqt | data/5T/5TBO-ORO/5TBO-ORO_decoy_scores.csv |
5TVF-B3P | data/5T/5TVF-B3P/5TVF-B3P_ligand.pdbqt | data/5T/5TVF-B3P/5TVF-B3P_target.pdbqt | data/5T/5TVF-B3P/5TVF-B3P_decoys.pdbqt | data/5T/5TVF-B3P/5TVF-B3P_decoy_scores.csv |
5TCY-5LC | data/5T/5TCY-5LC/5TCY-5LC_ligand.pdbqt | data/5T/5TCY-5LC/5TCY-5LC_target.pdbqt | data/5T/5TCY-5LC/5TCY-5LC_decoys.pdbqt | data/5T/5TCY-5LC/5TCY-5LC_decoy_scores.csv |
5TLF-7EF | data/5T/5TLF-7EF/5TLF-7EF_ligand.pdbqt | data/5T/5TLF-7EF/5TLF-7EF_target.pdbqt | data/5T/5TLF-7EF/5TLF-7EF_decoys.pdbqt | data/5T/5TLF-7EF/5TLF-7EF_decoy_scores.csv |
5TC4-NAD | data/5T/5TC4-NAD/5TC4-NAD_ligand.pdbqt | data/5T/5TC4-NAD/5TC4-NAD_target.pdbqt | data/5T/5TC4-NAD/5TC4-NAD_decoys.pdbqt | data/5T/5TC4-NAD/5TC4-NAD_decoy_scores.csv |
5TF4-NAD | data/5T/5TF4-NAD/5TF4-NAD_ligand.pdbqt | data/5T/5TF4-NAD/5TF4-NAD_target.pdbqt | data/5T/5TF4-NAD/5TF4-NAD_decoys.pdbqt | data/5T/5TF4-NAD/5TF4-NAD_decoy_scores.csv |
5TQZ-GLC | data/5T/5TQZ-GLC/5TQZ-GLC_ligand.pdbqt | data/5T/5TQZ-GLC/5TQZ-GLC_target.pdbqt | data/5T/5TQZ-GLC/5TQZ-GLC_decoys.pdbqt | data/5T/5TQZ-GLC/5TQZ-GLC_decoy_scores.csv |
5TNN-7F2 | data/5T/5TNN-7F2/5TNN-7F2_ligand.pdbqt | data/5T/5TNN-7F2/5TNN-7F2_target.pdbqt | data/5T/5TNN-7F2/5TNN-7F2_decoys.pdbqt | data/5T/5TNN-7F2/5TNN-7F2_decoy_scores.csv |
5TWE-CAZ | data/5T/5TWE-CAZ/5TWE-CAZ_ligand.pdbqt | data/5T/5TWE-CAZ/5TWE-CAZ_target.pdbqt | data/5T/5TWE-CAZ/5TWE-CAZ_decoys.pdbqt | data/5T/5TWE-CAZ/5TWE-CAZ_decoy_scores.csv |
5TM4-7E3 | data/5T/5TM4-7E3/5TM4-7E3_ligand.pdbqt | data/5T/5TM4-7E3/5TM4-7E3_target.pdbqt | data/5T/5TM4-7E3/5TM4-7E3_decoys.pdbqt | data/5T/5TM4-7E3/5TM4-7E3_decoy_scores.csv |
5TLW-RD3 | data/5T/5TLW-RD3/5TLW-RD3_ligand.pdbqt | data/5T/5TLW-RD3/5TLW-RD3_target.pdbqt | data/5T/5TLW-RD3/5TLW-RD3_decoys.pdbqt | data/5T/5TLW-RD3/5TLW-RD3_decoy_scores.csv |
5TF5-7AR | data/5T/5TF5-7AR/5TF5-7AR_ligand.pdbqt | data/5T/5TF5-7AR/5TF5-7AR_target.pdbqt | data/5T/5TF5-7AR/5TF5-7AR_decoys.pdbqt | data/5T/5TF5-7AR/5TF5-7AR_decoy_scores.csv |
5TVX-ADP | data/5T/5TVX-ADP/5TVX-ADP_ligand.pdbqt | data/5T/5TVX-ADP/5TVX-ADP_target.pdbqt | data/5T/5TVX-ADP/5TVX-ADP_decoys.pdbqt | data/5T/5TVX-ADP/5TVX-ADP_decoy_scores.csv |
5TJY-NAI | data/5T/5TJY-NAI/5TJY-NAI_ligand.pdbqt | data/5T/5TJY-NAI/5TJY-NAI_target.pdbqt | data/5T/5TJY-NAI/5TJY-NAI_decoys.pdbqt | data/5T/5TJY-NAI/5TJY-NAI_decoy_scores.csv |
5TNP-FEH | data/5T/5TNP-FEH/5TNP-FEH_ligand.pdbqt | data/5T/5TNP-FEH/5TNP-FEH_target.pdbqt | data/5T/5TNP-FEH/5TNP-FEH_decoys.pdbqt | data/5T/5TNP-FEH/5TNP-FEH_decoy_scores.csv |
5TZD-C2E | data/5T/5TZD-C2E/5TZD-C2E_ligand.pdbqt | data/5T/5TZD-C2E/5TZD-C2E_target.pdbqt | data/5T/5TZD-C2E/5TZD-C2E_decoys.pdbqt | data/5T/5TZD-C2E/5TZD-C2E_decoy_scores.csv |
5T2P-K89 | data/5T/5T2P-K89/5T2P-K89_ligand.pdbqt | data/5T/5T2P-K89/5T2P-K89_target.pdbqt | data/5T/5T2P-K89/5T2P-K89_decoys.pdbqt | data/5T/5T2P-K89/5T2P-K89_decoy_scores.csv |
5TH7-7BY | data/5T/5TH7-7BY/5TH7-7BY_ligand.pdbqt | data/5T/5TH7-7BY/5TH7-7BY_target.pdbqt | data/5T/5TH7-7BY/5TH7-7BY_decoys.pdbqt | data/5T/5TH7-7BY/5TH7-7BY_decoy_scores.csv |
5T9K-LYS | data/5T/5T9K-LYS/5T9K-LYS_ligand.pdbqt | data/5T/5T9K-LYS/5T9K-LYS_target.pdbqt | data/5T/5T9K-LYS/5T9K-LYS_decoys.pdbqt | data/5T/5T9K-LYS/5T9K-LYS_decoy_scores.csv |
5TLS-ZD2 | data/5T/5TLS-ZD2/5TLS-ZD2_ligand.pdbqt | data/5T/5TLS-ZD2/5TLS-ZD2_target.pdbqt | data/5T/5TLS-ZD2/5TLS-ZD2_decoys.pdbqt | data/5T/5TLS-ZD2/5TLS-ZD2_decoy_scores.csv |
5TC3-GDP | data/5T/5TC3-GDP/5TC3-GDP_ligand.pdbqt | data/5T/5TC3-GDP/5TC3-GDP_target.pdbqt | data/5T/5TC3-GDP/5TC3-GDP_decoys.pdbqt | data/5T/5TC3-GDP/5TC3-GDP_decoy_scores.csv |
5TW4-AI8 | data/5T/5TW4-AI8/5TW4-AI8_ligand.pdbqt | data/5T/5TW4-AI8/5TW4-AI8_target.pdbqt | data/5T/5TW4-AI8/5TW4-AI8_decoys.pdbqt | data/5T/5TW4-AI8/5TW4-AI8_decoy_scores.csv |
5T5U-75T | data/5T/5T5U-75T/5T5U-75T_ligand.pdbqt | data/5T/5T5U-75T/5T5U-75T_target.pdbqt | data/5T/5T5U-75T/5T5U-75T_decoys.pdbqt | data/5T/5T5U-75T/5T5U-75T_decoy_scores.csv |
5TU4-DST | data/5T/5TU4-DST/5TU4-DST_ligand.pdbqt | data/5T/5TU4-DST/5TU4-DST_target.pdbqt | data/5T/5TU4-DST/5TU4-DST_decoys.pdbqt | data/5T/5TU4-DST/5TU4-DST_decoy_scores.csv |
5T6M-78U | data/5T/5T6M-78U/5T6M-78U_ligand.pdbqt | data/5T/5T6M-78U/5T6M-78U_target.pdbqt | data/5T/5T6M-78U/5T6M-78U_decoys.pdbqt | data/5T/5T6M-78U/5T6M-78U_decoy_scores.csv |
5TNT-NHE | data/5T/5TNT-NHE/5TNT-NHE_ligand.pdbqt | data/5T/5TNT-NHE/5TNT-NHE_target.pdbqt | data/5T/5TNT-NHE/5TNT-NHE_decoys.pdbqt | data/5T/5TNT-NHE/5TNT-NHE_decoy_scores.csv |
5TEI-M39 | data/5T/5TEI-M39/5TEI-M39_ligand.pdbqt | data/5T/5TEI-M39/5TEI-M39_target.pdbqt | null | null |
5TBV-TBN | data/5T/5TBV-TBN/5TBV-TBN_ligand.pdbqt | data/5T/5TBV-TBN/5TBV-TBN_target.pdbqt | data/5T/5TBV-TBN/5TBV-TBN_decoys.pdbqt | data/5T/5TBV-TBN/5TBV-TBN_decoy_scores.csv |
5TI9-TRP | data/5T/5TI9-TRP/5TI9-TRP_ligand.pdbqt | data/5T/5TI9-TRP/5TI9-TRP_target.pdbqt | data/5T/5TI9-TRP/5TI9-TRP_decoys.pdbqt | data/5T/5TI9-TRP/5TI9-TRP_decoy_scores.csv |
5T2I-74J | data/5T/5T2I-74J/5T2I-74J_ligand.pdbqt | data/5T/5T2I-74J/5T2I-74J_target.pdbqt | data/5T/5T2I-74J/5T2I-74J_decoys.pdbqt | data/5T/5T2I-74J/5T2I-74J_decoy_scores.csv |
5T4U-12Q | data/5T/5T4U-12Q/5T4U-12Q_ligand.pdbqt | data/5T/5T4U-12Q/5T4U-12Q_target.pdbqt | data/5T/5T4U-12Q/5T4U-12Q_decoys.pdbqt | data/5T/5T4U-12Q/5T4U-12Q_decoy_scores.csv |
5TK9-7D7 | data/5T/5TK9-7D7/5TK9-7D7_ligand.pdbqt | data/5T/5TK9-7D7/5TK9-7D7_target.pdbqt | data/5T/5TK9-7D7/5TK9-7D7_decoys.pdbqt | data/5T/5TK9-7D7/5TK9-7D7_decoy_scores.csv |
5TIU-7CU | data/5T/5TIU-7CU/5TIU-7CU_ligand.pdbqt | data/5T/5TIU-7CU/5TIU-7CU_target.pdbqt | data/5T/5TIU-7CU/5TIU-7CU_decoys.pdbqt | data/5T/5TIU-7CU/5TIU-7CU_decoy_scores.csv |
5T8K-P6G | data/5T/5T8K-P6G/5T8K-P6G_ligand.pdbqt | data/5T/5T8K-P6G/5T8K-P6G_target.pdbqt | data/5T/5T8K-P6G/5T8K-P6G_decoys.pdbqt | data/5T/5T8K-P6G/5T8K-P6G_decoy_scores.csv |
5T75-4WA | data/5T/5T75-4WA/5T75-4WA_ligand.pdbqt | data/5T/5T75-4WA/5T75-4WA_target.pdbqt | data/5T/5T75-4WA/5T75-4WA_decoys.pdbqt | data/5T/5T75-4WA/5T75-4WA_decoy_scores.csv |
5TEG-SAM | data/5T/5TEG-SAM/5TEG-SAM_ligand.pdbqt | data/5T/5TEG-SAM/5TEG-SAM_target.pdbqt | data/5T/5TEG-SAM/5TEG-SAM_decoys.pdbqt | data/5T/5TEG-SAM/5TEG-SAM_decoy_scores.csv |
5TEI-NAI | data/5T/5TEI-NAI/5TEI-NAI_ligand.pdbqt | data/5T/5TEI-NAI/5TEI-NAI_target.pdbqt | null | null |
5TBO-FMN | data/5T/5TBO-FMN/5TBO-FMN_ligand.pdbqt | data/5T/5TBO-FMN/5TBO-FMN_target.pdbqt | data/5T/5TBO-FMN/5TBO-FMN_decoys.pdbqt | data/5T/5TBO-FMN/5TBO-FMN_decoy_scores.csv |
5TWL-H91 | data/5T/5TWL-H91/5TWL-H91_ligand.pdbqt | data/5T/5TWL-H91/5TWL-H91_target.pdbqt | data/5T/5TWL-H91/5TWL-H91_decoys.pdbqt | data/5T/5TWL-H91/5TWL-H91_decoy_scores.csv |
5TQF-7KR | data/5T/5TQF-7KR/5TQF-7KR_ligand.pdbqt | data/5T/5TQF-7KR/5TQF-7KR_target.pdbqt | data/5T/5TQF-7KR/5TQF-7KR_decoys.pdbqt | data/5T/5TQF-7KR/5TQF-7KR_decoy_scores.csv |
5TRI-23E | data/5T/5TRI-23E/5TRI-23E_ligand.pdbqt | data/5T/5TRI-23E/5TRI-23E_target.pdbqt | data/5T/5TRI-23E/5TRI-23E_decoys.pdbqt | data/5T/5TRI-23E/5TRI-23E_decoy_scores.csv |
5T9Z-78R | data/5T/5T9Z-78R/5T9Z-78R_ligand.pdbqt | data/5T/5T9Z-78R/5T9Z-78R_target.pdbqt | data/5T/5T9Z-78R/5T9Z-78R_decoys.pdbqt | data/5T/5T9Z-78R/5T9Z-78R_decoy_scores.csv |
5TM1-7EQ | data/5T/5TM1-7EQ/5TM1-7EQ_ligand.pdbqt | data/5T/5TM1-7EQ/5TM1-7EQ_target.pdbqt | data/5T/5TM1-7EQ/5TM1-7EQ_decoys.pdbqt | data/5T/5TM1-7EQ/5TM1-7EQ_decoy_scores.csv |
5TQ5-7GX | data/5T/5TQ5-7GX/5TQ5-7GX_ligand.pdbqt | data/5T/5TQ5-7GX/5TQ5-7GX_target.pdbqt | data/5T/5TQ5-7GX/5TQ5-7GX_decoys.pdbqt | data/5T/5TQ5-7GX/5TQ5-7GX_decoy_scores.csv |
5T3N-75G | data/5T/5T3N-75G/5T3N-75G_ligand.pdbqt | data/5T/5T3N-75G/5T3N-75G_target.pdbqt | data/5T/5T3N-75G/5T3N-75G_decoys.pdbqt | data/5T/5T3N-75G/5T3N-75G_decoy_scores.csv |
5T38-SAH | data/5T/5T38-SAH/5T38-SAH_ligand.pdbqt | data/5T/5T38-SAH/5T38-SAH_target.pdbqt | data/5T/5T38-SAH/5T38-SAH_decoys.pdbqt | data/5T/5T38-SAH/5T38-SAH_decoy_scores.csv |
5TR6-7KG | data/5T/5TR6-7KG/5TR6-7KG_ligand.pdbqt | data/5T/5TR6-7KG/5TR6-7KG_target.pdbqt | data/5T/5TR6-7KG/5TR6-7KG_decoys.pdbqt | data/5T/5TR6-7KG/5TR6-7KG_decoy_scores.csv |
5TBJ-LHD | data/5T/5TBJ-LHD/5TBJ-LHD_ligand.pdbqt | data/5T/5TBJ-LHD/5TBJ-LHD_target.pdbqt | data/5T/5TBJ-LHD/5TBJ-LHD_decoys.pdbqt | data/5T/5TBJ-LHD/5TBJ-LHD_decoy_scores.csv |
5TA2-78X | data/5T/5TA2-78X/5TA2-78X_ligand.pdbqt | data/5T/5TA2-78X/5TA2-78X_target.pdbqt | data/5T/5TA2-78X/5TA2-78X_decoys.pdbqt | data/5T/5TA2-78X/5TA2-78X_decoy_scores.csv |
5TSH-ANP | data/5T/5TSH-ANP/5TSH-ANP_ligand.pdbqt | data/5T/5TSH-ANP/5TSH-ANP_target.pdbqt | data/5T/5TSH-ANP/5TSH-ANP_decoys.pdbqt | data/5T/5TSH-ANP/5TSH-ANP_decoy_scores.csv |
5TCO-79Q | data/5T/5TCO-79Q/5TCO-79Q_ligand.pdbqt | data/5T/5TCO-79Q/5TCO-79Q_target.pdbqt | data/5T/5TCO-79Q/5TCO-79Q_decoys.pdbqt | data/5T/5TCO-79Q/5TCO-79Q_decoy_scores.csv |
5TQ7-7GT | data/5T/5TQ7-7GT/5TQ7-7GT_ligand.pdbqt | data/5T/5TQ7-7GT/5TQ7-7GT_target.pdbqt | data/5T/5TQ7-7GT/5TQ7-7GT_decoys.pdbqt | data/5T/5TQ7-7GT/5TQ7-7GT_decoy_scores.csv |
5TSO-NAD | data/5T/5TSO-NAD/5TSO-NAD_ligand.pdbqt | data/5T/5TSO-NAD/5TSO-NAD_target.pdbqt | data/5T/5TSO-NAD/5TSO-NAD_decoys.pdbqt | data/5T/5TSO-NAD/5TSO-NAD_decoy_scores.csv |
5TPR-NAD | data/5T/5TPR-NAD/5TPR-NAD_ligand.pdbqt | data/5T/5TPR-NAD/5TPR-NAD_target.pdbqt | data/5T/5TPR-NAD/5TPR-NAD_decoys.pdbqt | data/5T/5TPR-NAD/5TPR-NAD_decoy_scores.csv |
5T8K-NAD | data/5T/5T8K-NAD/5T8K-NAD_ligand.pdbqt | data/5T/5T8K-NAD/5T8K-NAD_target.pdbqt | data/5T/5T8K-NAD/5T8K-NAD_decoys.pdbqt | data/5T/5T8K-NAD/5T8K-NAD_decoy_scores.csv |
5T6B-TMP | data/5T/5T6B-TMP/5T6B-TMP_ligand.pdbqt | data/5T/5T6B-TMP/5T6B-TMP_target.pdbqt | data/5T/5T6B-TMP/5T6B-TMP_decoys.pdbqt | data/5T/5T6B-TMP/5T6B-TMP_decoy_scores.csv |
5TEJ-NAD | data/5T/5TEJ-NAD/5TEJ-NAD_ligand.pdbqt | data/5T/5TEJ-NAD/5TEJ-NAD_target.pdbqt | data/5T/5TEJ-NAD/5TEJ-NAD_decoys.pdbqt | data/5T/5TEJ-NAD/5TEJ-NAD_decoy_scores.csv |
5TS3-NAD | data/5T/5TS3-NAD/5TS3-NAD_ligand.pdbqt | data/5T/5TS3-NAD/5TS3-NAD_target.pdbqt | data/5T/5TS3-NAD/5TS3-NAD_decoys.pdbqt | data/5T/5TS3-NAD/5TS3-NAD_decoy_scores.csv |
5T9F-TYR | data/5T/5T9F-TYR/5T9F-TYR_ligand.pdbqt | data/5T/5T9F-TYR/5T9F-TYR_target.pdbqt | data/5T/5T9F-TYR/5T9F-TYR_decoys.pdbqt | data/5T/5T9F-TYR/5T9F-TYR_decoy_scores.csv |
5TLP-7ET | data/5T/5TLP-7ET/5TLP-7ET_ligand.pdbqt | data/5T/5TLP-7ET/5TLP-7ET_target.pdbqt | data/5T/5TLP-7ET/5TLP-7ET_decoys.pdbqt | data/5T/5TLP-7ET/5TLP-7ET_decoy_scores.csv |
5TOW-NAI | data/5T/5TOW-NAI/5TOW-NAI_ligand.pdbqt | data/5T/5TOW-NAI/5TOW-NAI_target.pdbqt | data/5T/5TOW-NAI/5TOW-NAI_decoys.pdbqt | data/5T/5TOW-NAI/5TOW-NAI_decoy_scores.csv |
5TOE-7GK | data/5T/5TOE-7GK/5TOE-7GK_ligand.pdbqt | data/5T/5TOE-7GK/5TOE-7GK_target.pdbqt | data/5T/5TOE-7GK/5TOE-7GK_decoys.pdbqt | data/5T/5TOE-7GK/5TOE-7GK_decoy_scores.csv |
5TA6-79D | data/5T/5TA6-79D/5TA6-79D_ligand.pdbqt | data/5T/5TA6-79D/5TA6-79D_target.pdbqt | data/5T/5TA6-79D/5TA6-79D_decoys.pdbqt | data/5T/5TA6-79D/5TA6-79D_decoy_scores.csv |
5TLL-7EL | data/5T/5TLL-7EL/5TLL-7EL_ligand.pdbqt | data/5T/5TLL-7EL/5TLL-7EL_target.pdbqt | data/5T/5TLL-7EL/5TLL-7EL_decoys.pdbqt | data/5T/5TLL-7EL/5TLL-7EL_decoy_scores.csv |
5TAK-LYS | data/5T/5TAK-LYS/5TAK-LYS_ligand.pdbqt | data/5T/5TAK-LYS/5TAK-LYS_target.pdbqt | data/5T/5TAK-LYS/5TAK-LYS_decoys.pdbqt | data/5T/5TAK-LYS/5TAK-LYS_decoy_scores.csv |
5TMD-U2F | data/5T/5TMD-U2F/5TMD-U2F_ligand.pdbqt | data/5T/5TMD-U2F/5TMD-U2F_target.pdbqt | data/5T/5TMD-U2F/5TMD-U2F_decoys.pdbqt | data/5T/5TMD-U2F/5TMD-U2F_decoy_scores.csv |
5T8P-774 | data/5T/5T8P-774/5T8P-774_ligand.pdbqt | data/5T/5T8P-774/5T8P-774_target.pdbqt | data/5T/5T8P-774/5T8P-774_decoys.pdbqt | data/5T/5T8P-774/5T8P-774_decoy_scores.csv |
5TMR-7FD | data/5T/5TMR-7FD/5TMR-7FD_ligand.pdbqt | data/5T/5TMR-7FD/5TMR-7FD_target.pdbqt | data/5T/5TMR-7FD/5TMR-7FD_decoys.pdbqt | data/5T/5TMR-7FD/5TMR-7FD_decoy_scores.csv |
5TIW-OAQ | data/5T/5TIW-OAQ/5TIW-OAQ_ligand.pdbqt | data/5T/5TIW-OAQ/5TIW-OAQ_target.pdbqt | data/5T/5TIW-OAQ/5TIW-OAQ_decoys.pdbqt | data/5T/5TIW-OAQ/5TIW-OAQ_decoy_scores.csv |
5TF8-TTP | data/5T/5TF8-TTP/5TF8-TTP_ligand.pdbqt | data/5T/5TF8-TTP/5TF8-TTP_target.pdbqt | data/5T/5TF8-TTP/5TF8-TTP_decoys.pdbqt | data/5T/5TF8-TTP/5TF8-TTP_decoy_scores.csv |
5TNJ-BVH | data/5T/5TNJ-BVH/5TNJ-BVH_ligand.pdbqt | data/5T/5TNJ-BVH/5TNJ-BVH_target.pdbqt | data/5T/5TNJ-BVH/5TNJ-BVH_decoys.pdbqt | data/5T/5TNJ-BVH/5TNJ-BVH_decoy_scores.csv |
5T0M-SAM | data/5T/5T0M-SAM/5T0M-SAM_ligand.pdbqt | data/5T/5T0M-SAM/5T0M-SAM_target.pdbqt | data/5T/5T0M-SAM/5T0M-SAM_decoys.pdbqt | data/5T/5T0M-SAM/5T0M-SAM_decoy_scores.csv |
5TKB-7DJ | data/5T/5TKB-7DJ/5TKB-7DJ_ligand.pdbqt | data/5T/5TKB-7DJ/5TKB-7DJ_target.pdbqt | data/5T/5TKB-7DJ/5TKB-7DJ_decoys.pdbqt | data/5T/5TKB-7DJ/5TKB-7DJ_decoy_scores.csv |
5TBJ-PG6 | data/5T/5TBJ-PG6/5TBJ-PG6_ligand.pdbqt | data/5T/5TBJ-PG6/5TBJ-PG6_target.pdbqt | data/5T/5TBJ-PG6/5TBJ-PG6_decoys.pdbqt | data/5T/5TBJ-PG6/5TBJ-PG6_decoy_scores.csv |
5TEM-NAD | data/5T/5TEM-NAD/5TEM-NAD_ligand.pdbqt | data/5T/5TEM-NAD/5TEM-NAD_target.pdbqt | data/5T/5TEM-NAD/5TEM-NAD_decoys.pdbqt | data/5T/5TEM-NAD/5TEM-NAD_decoy_scores.csv |
5THU-B3N | data/5T/5THU-B3N/5THU-B3N_ligand.pdbqt | data/5T/5THU-B3N/5THU-B3N_target.pdbqt | data/5T/5THU-B3N/5THU-B3N_decoys.pdbqt | data/5T/5THU-B3N/5THU-B3N_decoy_scores.csv |
3LIQ-E14 | data/3L/3LIQ-E14/3LIQ-E14_ligand.pdbqt | data/3L/3LIQ-E14/3LIQ-E14_target.pdbqt | data/3L/3LIQ-E14/3LIQ-E14_decoys.pdbqt | data/3L/3LIQ-E14/3LIQ-E14_decoy_scores.csv |
3LT1-FT2 | data/3L/3LT1-FT2/3LT1-FT2_ligand.pdbqt | data/3L/3LT1-FT2/3LT1-FT2_target.pdbqt | data/3L/3LT1-FT2/3LT1-FT2_decoys.pdbqt | data/3L/3LT1-FT2/3LT1-FT2_decoy_scores.csv |
3LS4-TCI | data/3L/3LS4-TCI/3LS4-TCI_ligand.pdbqt | data/3L/3LS4-TCI/3LS4-TCI_target.pdbqt | data/3L/3LS4-TCI/3LS4-TCI_decoys.pdbqt | data/3L/3LS4-TCI/3LS4-TCI_decoy_scores.csv |
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