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 ⌀ |
|---|---|---|---|---|
6W2Z-NXL | data/6W/6W2Z-NXL/6W2Z-NXL_ligand.pdbqt | data/6W/6W2Z-NXL/6W2Z-NXL_target.pdbqt | data/6W/6W2Z-NXL/6W2Z-NXL_decoys.pdbqt | data/6W/6W2Z-NXL/6W2Z-NXL_decoy_scores.csv |
6WTO-3JW | data/6W/6WTO-3JW/6WTO-3JW_ligand.pdbqt | data/6W/6WTO-3JW/6WTO-3JW_target.pdbqt | data/6W/6WTO-3JW/6WTO-3JW_decoys.pdbqt | data/6W/6WTO-3JW/6WTO-3JW_decoy_scores.csv |
6WGW-CAH | data/6W/6WGW-CAH/6WGW-CAH_ligand.pdbqt | data/6W/6WGW-CAH/6WGW-CAH_target.pdbqt | data/6W/6WGW-CAH/6WGW-CAH_decoys.pdbqt | data/6W/6WGW-CAH/6WGW-CAH_decoy_scores.csv |
6WJA-NAD | data/6W/6WJA-NAD/6WJA-NAD_ligand.pdbqt | data/6W/6WJA-NAD/6WJA-NAD_target.pdbqt | data/6W/6WJA-NAD/6WJA-NAD_decoys.pdbqt | data/6W/6WJA-NAD/6WJA-NAD_decoy_scores.csv |
6WGH-GDP | data/6W/6WGH-GDP/6WGH-GDP_ligand.pdbqt | data/6W/6WGH-GDP/6WGH-GDP_target.pdbqt | data/6W/6WGH-GDP/6WGH-GDP_decoys.pdbqt | data/6W/6WGH-GDP/6WGH-GDP_decoy_scores.csv |
6WKQ-SFG | data/6W/6WKQ-SFG/6WKQ-SFG_ligand.pdbqt | data/6W/6WKQ-SFG/6WKQ-SFG_target.pdbqt | data/6W/6WKQ-SFG/6WKQ-SFG_decoys.pdbqt | data/6W/6WKQ-SFG/6WKQ-SFG_decoy_scores.csv |
6WKD-FDF | data/6W/6WKD-FDF/6WKD-FDF_ligand.pdbqt | data/6W/6WKD-FDF/6WKD-FDF_target.pdbqt | data/6W/6WKD-FDF/6WKD-FDF_decoys.pdbqt | data/6W/6WKD-FDF/6WKD-FDF_decoy_scores.csv |
6WTT-B1S | data/6W/6WTT-B1S/6WTT-B1S_ligand.pdbqt | data/6W/6WTT-B1S/6WTT-B1S_target.pdbqt | data/6W/6WTT-B1S/6WTT-B1S_decoys.pdbqt | data/6W/6WTT-B1S/6WTT-B1S_decoy_scores.csv |
6WN2-TYS | data/6W/6WN2-TYS/6WN2-TYS_ligand.pdbqt | data/6W/6WN2-TYS/6WN2-TYS_target.pdbqt | data/6W/6WN2-TYS/6WN2-TYS_decoys.pdbqt | data/6W/6WN2-TYS/6WN2-TYS_decoy_scores.csv |
6WH8-SAH | data/6W/6WH8-SAH/6WH8-SAH_ligand.pdbqt | data/6W/6WH8-SAH/6WH8-SAH_target.pdbqt | data/6W/6WH8-SAH/6WH8-SAH_decoys.pdbqt | data/6W/6WH8-SAH/6WH8-SAH_decoy_scores.csv |
6WQT-U81 | data/6W/6WQT-U81/6WQT-U81_ligand.pdbqt | data/6W/6WQT-U81/6WQT-U81_target.pdbqt | data/6W/6WQT-U81/6WQT-U81_decoys.pdbqt | data/6W/6WQT-U81/6WQT-U81_decoy_scores.csv |
6WTT-K36 | data/6W/6WTT-K36/6WTT-K36_ligand.pdbqt | data/6W/6WTT-K36/6WTT-K36_target.pdbqt | data/6W/6WTT-K36/6WTT-K36_decoys.pdbqt | data/6W/6WTT-K36/6WTT-K36_decoy_scores.csv |
6WXN-UEJ | data/6W/6WXN-UEJ/6WXN-UEJ_ligand.pdbqt | data/6W/6WXN-UEJ/6WXN-UEJ_target.pdbqt | data/6W/6WXN-UEJ/6WXN-UEJ_decoys.pdbqt | data/6W/6WXN-UEJ/6WXN-UEJ_decoy_scores.csv |
6W5L-T0D | data/6W/6W5L-T0D/6W5L-T0D_ligand.pdbqt | data/6W/6W5L-T0D/6W5L-T0D_target.pdbqt | data/6W/6W5L-T0D/6W5L-T0D_decoys.pdbqt | data/6W/6W5L-T0D/6W5L-T0D_decoy_scores.csv |
6W4R-MPO | data/6W/6W4R-MPO/6W4R-MPO_ligand.pdbqt | data/6W/6W4R-MPO/6W4R-MPO_target.pdbqt | data/6W/6W4R-MPO/6W4R-MPO_decoys.pdbqt | data/6W/6W4R-MPO/6W4R-MPO_decoy_scores.csv |
6WE4-TYG | data/6W/6WE4-TYG/6WE4-TYG_ligand.pdbqt | data/6W/6WE4-TYG/6WE4-TYG_target.pdbqt | data/6W/6WE4-TYG/6WE4-TYG_decoys.pdbqt | data/6W/6WE4-TYG/6WE4-TYG_decoy_scores.csv |
6WHE-GTP | data/6W/6WHE-GTP/6WHE-GTP_ligand.pdbqt | data/6W/6WHE-GTP/6WHE-GTP_target.pdbqt | data/6W/6WHE-GTP/6WHE-GTP_decoys.pdbqt | data/6W/6WHE-GTP/6WHE-GTP_decoy_scores.csv |
6W4Z-SZS | data/6W/6W4Z-SZS/6W4Z-SZS_ligand.pdbqt | data/6W/6W4Z-SZS/6W4Z-SZS_target.pdbqt | data/6W/6W4Z-SZS/6W4Z-SZS_decoys.pdbqt | data/6W/6W4Z-SZS/6W4Z-SZS_decoy_scores.csv |
6WJT-SAH | data/6W/6WJT-SAH/6WJT-SAH_ligand.pdbqt | data/6W/6WJT-SAH/6WJT-SAH_target.pdbqt | data/6W/6WJT-SAH/6WJT-SAH_decoys.pdbqt | data/6W/6WJT-SAH/6WJT-SAH_decoy_scores.csv |
6WZW-SAM | data/6W/6WZW-SAM/6WZW-SAM_ligand.pdbqt | data/6W/6WZW-SAM/6WZW-SAM_target.pdbqt | data/6W/6WZW-SAM/6WZW-SAM_decoys.pdbqt | data/6W/6WZW-SAM/6WZW-SAM_decoy_scores.csv |
6WH6-UQ1 | data/6W/6WH6-UQ1/6WH6-UQ1_ligand.pdbqt | data/6W/6WH6-UQ1/6WH6-UQ1_target.pdbqt | data/6W/6WH6-UQ1/6WH6-UQ1_decoys.pdbqt | data/6W/6WH6-UQ1/6WH6-UQ1_decoy_scores.csv |
6W61-SAM | data/6W/6W61-SAM/6W61-SAM_ligand.pdbqt | data/6W/6W61-SAM/6W61-SAM_target.pdbqt | data/6W/6W61-SAM/6W61-SAM_decoys.pdbqt | data/6W/6W61-SAM/6W61-SAM_decoy_scores.csv |
6WI3-NHE | data/6W/6WI3-NHE/6WI3-NHE_ligand.pdbqt | data/6W/6WI3-NHE/6WI3-NHE_target.pdbqt | data/6W/6WI3-NHE/6WI3-NHE_decoys.pdbqt | data/6W/6WI3-NHE/6WI3-NHE_decoy_scores.csv |
6WW1-IPR | data/6W/6WW1-IPR/6WW1-IPR_ligand.pdbqt | data/6W/6WW1-IPR/6WW1-IPR_target.pdbqt | data/6W/6WW1-IPR/6WW1-IPR_decoys.pdbqt | data/6W/6WW1-IPR/6WW1-IPR_decoy_scores.csv |
6WV7-UAJ | data/6W/6WV7-UAJ/6WV7-UAJ_ligand.pdbqt | data/6W/6WV7-UAJ/6WV7-UAJ_target.pdbqt | data/6W/6WV7-UAJ/6WV7-UAJ_decoys.pdbqt | data/6W/6WV7-UAJ/6WV7-UAJ_decoy_scores.csv |
6WOJ-APR | data/6W/6WOJ-APR/6WOJ-APR_ligand.pdbqt | data/6W/6WOJ-APR/6WOJ-APR_target.pdbqt | data/6W/6WOJ-APR/6WOJ-APR_decoys.pdbqt | data/6W/6WOJ-APR/6WOJ-APR_decoy_scores.csv |
6WJ9-NAD | data/6W/6WJ9-NAD/6WJ9-NAD_ligand.pdbqt | data/6W/6WJ9-NAD/6WJ9-NAD_target.pdbqt | data/6W/6WJ9-NAD/6WJ9-NAD_decoys.pdbqt | data/6W/6WJ9-NAD/6WJ9-NAD_decoy_scores.csv |
6W7K-TG7 | data/6W/6W7K-TG7/6W7K-TG7_ligand.pdbqt | data/6W/6W7K-TG7/6W7K-TG7_target.pdbqt | data/6W/6W7K-TG7/6W7K-TG7_decoys.pdbqt | data/6W/6W7K-TG7/6W7K-TG7_decoy_scores.csv |
6WGS-5AD | data/6W/6WGS-5AD/6WGS-5AD_ligand.pdbqt | data/6W/6WGS-5AD/6WGS-5AD_target.pdbqt | data/6W/6WGS-5AD/6WGS-5AD_decoys.pdbqt | data/6W/6WGS-5AD/6WGS-5AD_decoy_scores.csv |
6W3K-SJS | data/6W/6W3K-SJS/6W3K-SJS_ligand.pdbqt | data/6W/6W3K-SJS/6W3K-SJS_target.pdbqt | data/6W/6W3K-SJS/6W3K-SJS_decoys.pdbqt | data/6W/6W3K-SJS/6W3K-SJS_decoy_scores.csv |
6WS4-GDP | data/6W/6WS4-GDP/6WS4-GDP_ligand.pdbqt | data/6W/6WS4-GDP/6WS4-GDP_target.pdbqt | data/6W/6WS4-GDP/6WS4-GDP_decoys.pdbqt | data/6W/6WS4-GDP/6WS4-GDP_decoy_scores.csv |
6WAD-SAH | data/6W/6WAD-SAH/6WAD-SAH_ligand.pdbqt | data/6W/6WAD-SAH/6WAD-SAH_target.pdbqt | data/6W/6WAD-SAH/6WAD-SAH_decoys.pdbqt | data/6W/6WAD-SAH/6WAD-SAH_decoy_scores.csv |
6WHO-NHE | data/6W/6WHO-NHE/6WHO-NHE_ligand.pdbqt | data/6W/6WHO-NHE/6WHO-NHE_target.pdbqt | data/6W/6WHO-NHE/6WHO-NHE_decoys.pdbqt | data/6W/6WHO-NHE/6WHO-NHE_decoy_scores.csv |
6WPE-U6G | data/6W/6WPE-U6G/6WPE-U6G_ligand.pdbqt | data/6W/6WPE-U6G/6WPE-U6G_target.pdbqt | data/6W/6WPE-U6G/6WPE-U6G_decoys.pdbqt | data/6W/6WPE-U6G/6WPE-U6G_decoy_scores.csv |
6WYH-RFT | data/6W/6WYH-RFT/6WYH-RFT_ligand.pdbqt | data/6W/6WYH-RFT/6WYH-RFT_target.pdbqt | data/6W/6WYH-RFT/6WYH-RFT_decoys.pdbqt | data/6W/6WYH-RFT/6WYH-RFT_decoy_scores.csv |
6WS2-GDP | data/6W/6WS2-GDP/6WS2-GDP_ligand.pdbqt | data/6W/6WS2-GDP/6WS2-GDP_target.pdbqt | data/6W/6WS2-GDP/6WS2-GDP_decoys.pdbqt | data/6W/6WS2-GDP/6WS2-GDP_decoy_scores.csv |
6W2N-SJD | data/6W/6W2N-SJD/6W2N-SJD_ligand.pdbqt | data/6W/6W2N-SJD/6W2N-SJD_target.pdbqt | data/6W/6W2N-SJD/6W2N-SJD_decoys.pdbqt | data/6W/6W2N-SJD/6W2N-SJD_decoy_scores.csv |
6WYF-RFT | data/6W/6WYF-RFT/6WYF-RFT_ligand.pdbqt | data/6W/6WYF-RFT/6WYF-RFT_target.pdbqt | data/6W/6WYF-RFT/6WYF-RFT_decoys.pdbqt | data/6W/6WYF-RFT/6WYF-RFT_decoy_scores.csv |
6W9R-FLC | data/6W/6W9R-FLC/6W9R-FLC_ligand.pdbqt | data/6W/6W9R-FLC/6W9R-FLC_target.pdbqt | data/6W/6W9R-FLC/6W9R-FLC_decoys.pdbqt | data/6W/6W9R-FLC/6W9R-FLC_decoy_scores.csv |
6WAK-TQA | data/6W/6WAK-TQA/6WAK-TQA_ligand.pdbqt | data/6W/6WAK-TQA/6WAK-TQA_target.pdbqt | data/6W/6WAK-TQA/6WAK-TQA_decoys.pdbqt | data/6W/6WAK-TQA/6WAK-TQA_decoy_scores.csv |
6W44-SLJ | data/6W/6W44-SLJ/6W44-SLJ_ligand.pdbqt | data/6W/6W44-SLJ/6W44-SLJ_target.pdbqt | data/6W/6W44-SLJ/6W44-SLJ_decoys.pdbqt | data/6W/6W44-SLJ/6W44-SLJ_decoy_scores.csv |
6WK0-ACP | data/6W/6WK0-ACP/6WK0-ACP_ligand.pdbqt | data/6W/6WK0-ACP/6WK0-ACP_target.pdbqt | data/6W/6WK0-ACP/6WK0-ACP_decoys.pdbqt | data/6W/6WK0-ACP/6WK0-ACP_decoy_scores.csv |
6W7V-LAB | data/6W/6W7V-LAB/6W7V-LAB_ligand.pdbqt | data/6W/6W7V-LAB/6W7V-LAB_target.pdbqt | data/6W/6W7V-LAB/6W7V-LAB_decoys.pdbqt | data/6W/6W7V-LAB/6W7V-LAB_decoy_scores.csv |
6WIH-P15 | data/6W/6WIH-P15/6WIH-P15_ligand.pdbqt | data/6W/6WIH-P15/6WIH-P15_target.pdbqt | data/6W/6WIH-P15/6WIH-P15_decoys.pdbqt | data/6W/6WIH-P15/6WIH-P15_decoy_scores.csv |
6WQ8-U77 | data/6W/6WQ8-U77/6WQ8-U77_ligand.pdbqt | data/6W/6WQ8-U77/6WQ8-U77_target.pdbqt | data/6W/6WQ8-U77/6WQ8-U77_decoys.pdbqt | data/6W/6WQ8-U77/6WQ8-U77_decoy_scores.csv |
6WXC-CMU | data/6W/6WXC-CMU/6WXC-CMU_ligand.pdbqt | data/6W/6WXC-CMU/6WXC-CMU_target.pdbqt | data/6W/6WXC-CMU/6WXC-CMU_decoys.pdbqt | data/6W/6WXC-CMU/6WXC-CMU_decoy_scores.csv |
6WQA-OLC | data/6W/6WQA-OLC/6WQA-OLC_ligand.pdbqt | data/6W/6WQA-OLC/6WQA-OLC_target.pdbqt | data/6W/6WQA-OLC/6WQA-OLC_decoys.pdbqt | data/6W/6WQA-OLC/6WQA-OLC_decoy_scores.csv |
6W49-SWV | data/6W/6W49-SWV/6W49-SWV_ligand.pdbqt | data/6W/6W49-SWV/6W49-SWV_target.pdbqt | data/6W/6W49-SWV/6W49-SWV_decoys.pdbqt | data/6W/6W49-SWV/6W49-SWV_decoy_scores.csv |
6WIH-EDT | data/6W/6WIH-EDT/6WIH-EDT_ligand.pdbqt | data/6W/6WIH-EDT/6WIH-EDT_target.pdbqt | data/6W/6WIH-EDT/6WIH-EDT_decoys.pdbqt | data/6W/6WIH-EDT/6WIH-EDT_decoy_scores.csv |
6W3R-I2M | data/6W/6W3R-I2M/6W3R-I2M_ligand.pdbqt | data/6W/6W3R-I2M/6W3R-I2M_target.pdbqt | data/6W/6W3R-I2M/6W3R-I2M_decoys.pdbqt | data/6W/6W3R-I2M/6W3R-I2M_decoy_scores.csv |
6WR1-AER | data/6W/6WR1-AER/6WR1-AER_ligand.pdbqt | data/6W/6WR1-AER/6WR1-AER_target.pdbqt | data/6W/6WR1-AER/6WR1-AER_decoys.pdbqt | data/6W/6WR1-AER/6WR1-AER_decoy_scores.csv |
6WZP-MW7 | data/6W/6WZP-MW7/6WZP-MW7_ligand.pdbqt | data/6W/6WZP-MW7/6WZP-MW7_target.pdbqt | data/6W/6WZP-MW7/6WZP-MW7_decoys.pdbqt | data/6W/6WZP-MW7/6WZP-MW7_decoy_scores.csv |
6WOD-IHP | data/6W/6WOD-IHP/6WOD-IHP_ligand.pdbqt | data/6W/6WOD-IHP/6WOD-IHP_target.pdbqt | data/6W/6WOD-IHP/6WOD-IHP_decoys.pdbqt | data/6W/6WOD-IHP/6WOD-IHP_decoy_scores.csv |
6WQA-ZMA | data/6W/6WQA-ZMA/6WQA-ZMA_ligand.pdbqt | data/6W/6WQA-ZMA/6WQA-ZMA_target.pdbqt | data/6W/6WQA-ZMA/6WQA-ZMA_decoys.pdbqt | data/6W/6WQA-ZMA/6WQA-ZMA_decoy_scores.csv |
6WFO-U3Y | data/6W/6WFO-U3Y/6WFO-U3Y_ligand.pdbqt | data/6W/6WFO-U3Y/6WFO-U3Y_target.pdbqt | data/6W/6WFO-U3Y/6WFO-U3Y_decoys.pdbqt | data/6W/6WFO-U3Y/6WFO-U3Y_decoy_scores.csv |
6WTI-U9V | data/6W/6WTI-U9V/6WTI-U9V_ligand.pdbqt | data/6W/6WTI-U9V/6WTI-U9V_target.pdbqt | data/6W/6WTI-U9V/6WTI-U9V_decoys.pdbqt | data/6W/6WTI-U9V/6WTI-U9V_decoy_scores.csv |
6WYQ-UFJ | data/6W/6WYQ-UFJ/6WYQ-UFJ_ligand.pdbqt | data/6W/6WYQ-UFJ/6WYQ-UFJ_target.pdbqt | data/6W/6WYQ-UFJ/6WYQ-UFJ_decoys.pdbqt | data/6W/6WYQ-UFJ/6WYQ-UFJ_decoy_scores.csv |
6WFG-U3V | data/6W/6WFG-U3V/6WFG-U3V_ligand.pdbqt | data/6W/6WFG-U3V/6WFG-U3V_target.pdbqt | data/6W/6WFG-U3V/6WFG-U3V_decoys.pdbqt | data/6W/6WFG-U3V/6WFG-U3V_decoy_scores.csv |
6W0T-S6Y | data/6W/6W0T-S6Y/6W0T-S6Y_ligand.pdbqt | data/6W/6W0T-S6Y/6W0T-S6Y_target.pdbqt | data/6W/6W0T-S6Y/6W0T-S6Y_decoys.pdbqt | data/6W/6W0T-S6Y/6W0T-S6Y_decoy_scores.csv |
6WKF-FDF | data/6W/6WKF-FDF/6WKF-FDF_ligand.pdbqt | data/6W/6WKF-FDF/6WKF-FDF_target.pdbqt | data/6W/6WKF-FDF/6WKF-FDF_decoys.pdbqt | data/6W/6WKF-FDF/6WKF-FDF_decoy_scores.csv |
6W6D-SAH | data/6W/6W6D-SAH/6W6D-SAH_ligand.pdbqt | data/6W/6W6D-SAH/6W6D-SAH_target.pdbqt | data/6W/6W6D-SAH/6W6D-SAH_decoys.pdbqt | data/6W/6W6D-SAH/6W6D-SAH_decoy_scores.csv |
6WQA-OLB | data/6W/6WQA-OLB/6WQA-OLB_ligand.pdbqt | data/6W/6WQA-OLB/6WQA-OLB_target.pdbqt | data/6W/6WQA-OLB/6WQA-OLB_decoys.pdbqt | data/6W/6WQA-OLB/6WQA-OLB_decoy_scores.csv |
6W3P-SKJ | data/6W/6W3P-SKJ/6W3P-SKJ_ligand.pdbqt | data/6W/6W3P-SKJ/6W3P-SKJ_target.pdbqt | data/6W/6W3P-SKJ/6W3P-SKJ_decoys.pdbqt | data/6W/6W3P-SKJ/6W3P-SKJ_decoy_scores.csv |
6WRK-NIY | data/6W/6WRK-NIY/6WRK-NIY_ligand.pdbqt | data/6W/6WRK-NIY/6WRK-NIY_target.pdbqt | data/6W/6WRK-NIY/6WRK-NIY_decoys.pdbqt | data/6W/6WRK-NIY/6WRK-NIY_decoy_scores.csv |
6WBQ-N9W | data/6W/6WBQ-N9W/6WBQ-N9W_ligand.pdbqt | data/6W/6WBQ-N9W/6WBQ-N9W_target.pdbqt | data/6W/6WBQ-N9W/6WBQ-N9W_decoys.pdbqt | data/6W/6WBQ-N9W/6WBQ-N9W_decoy_scores.csv |
6W9H-TKJ | data/6W/6W9H-TKJ/6W9H-TKJ_ligand.pdbqt | data/6W/6W9H-TKJ/6W9H-TKJ_target.pdbqt | data/6W/6W9H-TKJ/6W9H-TKJ_decoys.pdbqt | data/6W/6W9H-TKJ/6W9H-TKJ_decoy_scores.csv |
6W4H-BDF | data/6W/6W4H-BDF/6W4H-BDF_ligand.pdbqt | data/6W/6W4H-BDF/6W4H-BDF_target.pdbqt | data/6W/6W4H-BDF/6W4H-BDF_decoys.pdbqt | data/6W/6W4H-BDF/6W4H-BDF_decoy_scores.csv |
6WM5-XP4 | data/6W/6WM5-XP4/6WM5-XP4_ligand.pdbqt | data/6W/6WM5-XP4/6WM5-XP4_target.pdbqt | data/6W/6WM5-XP4/6WM5-XP4_decoys.pdbqt | data/6W/6WM5-XP4/6WM5-XP4_decoy_scores.csv |
6W1D-P15 | data/6W/6W1D-P15/6W1D-P15_ligand.pdbqt | data/6W/6W1D-P15/6W1D-P15_target.pdbqt | data/6W/6W1D-P15/6W1D-P15_decoys.pdbqt | data/6W/6W1D-P15/6W1D-P15_decoy_scores.csv |
6WFL-CAH | data/6W/6WFL-CAH/6WFL-CAH_ligand.pdbqt | data/6W/6WFL-CAH/6WFL-CAH_target.pdbqt | data/6W/6WFL-CAH/6WFL-CAH_decoys.pdbqt | data/6W/6WFL-CAH/6WFL-CAH_decoy_scores.csv |
6W53-SZP | data/6W/6W53-SZP/6W53-SZP_ligand.pdbqt | data/6W/6W53-SZP/6W53-SZP_target.pdbqt | data/6W/6W53-SZP/6W53-SZP_decoys.pdbqt | data/6W/6W53-SZP/6W53-SZP_decoy_scores.csv |
6WF5-U44 | data/6W/6WF5-U44/6WF5-U44_ligand.pdbqt | data/6W/6WF5-U44/6WF5-U44_target.pdbqt | data/6W/6WF5-U44/6WF5-U44_decoys.pdbqt | data/6W/6WF5-U44/6WF5-U44_decoy_scores.csv |
6WGV-5AD | data/6W/6WGV-5AD/6WGV-5AD_ligand.pdbqt | data/6W/6WGV-5AD/6WGV-5AD_target.pdbqt | data/6W/6WGV-5AD/6WGV-5AD_decoys.pdbqt | data/6W/6WGV-5AD/6WGV-5AD_decoy_scores.csv |
6WZ6-GLU | data/6W/6WZ6-GLU/6WZ6-GLU_ligand.pdbqt | data/6W/6WZ6-GLU/6WZ6-GLU_target.pdbqt | data/6W/6WZ6-GLU/6WZ6-GLU_decoys.pdbqt | data/6W/6WZ6-GLU/6WZ6-GLU_decoy_scores.csv |
6W0U-S0Y | data/6W/6W0U-S0Y/6W0U-S0Y_ligand.pdbqt | data/6W/6W0U-S0Y/6W0U-S0Y_target.pdbqt | data/6W/6W0U-S0Y/6W0U-S0Y_decoys.pdbqt | data/6W/6W0U-S0Y/6W0U-S0Y_decoy_scores.csv |
6WS4-TCE | data/6W/6WS4-TCE/6WS4-TCE_ligand.pdbqt | data/6W/6WS4-TCE/6WS4-TCE_target.pdbqt | data/6W/6WS4-TCE/6WS4-TCE_decoys.pdbqt | data/6W/6WS4-TCE/6WS4-TCE_decoy_scores.csv |
6W45-SLG | data/6W/6W45-SLG/6W45-SLG_ligand.pdbqt | data/6W/6W45-SLG/6W45-SLG_target.pdbqt | data/6W/6W45-SLG/6W45-SLG_decoys.pdbqt | data/6W/6W45-SLG/6W45-SLG_decoy_scores.csv |
6WMV-TCE | data/6W/6WMV-TCE/6WMV-TCE_ligand.pdbqt | data/6W/6WMV-TCE/6WMV-TCE_target.pdbqt | data/6W/6WMV-TCE/6WMV-TCE_decoys.pdbqt | data/6W/6WMV-TCE/6WMV-TCE_decoy_scores.csv |
6WDV-TWM | data/6W/6WDV-TWM/6WDV-TWM_ligand.pdbqt | data/6W/6WDV-TWM/6WDV-TWM_target.pdbqt | data/6W/6WDV-TWM/6WDV-TWM_decoys.pdbqt | data/6W/6WDV-TWM/6WDV-TWM_decoy_scores.csv |
6W7I-IPR | data/6W/6W7I-IPR/6W7I-IPR_ligand.pdbqt | data/6W/6W7I-IPR/6W7I-IPR_target.pdbqt | data/6W/6W7I-IPR/6W7I-IPR_decoys.pdbqt | data/6W/6W7I-IPR/6W7I-IPR_decoy_scores.csv |
6W39-SJG | data/6W/6W39-SJG/6W39-SJG_ligand.pdbqt | data/6W/6W39-SJG/6W39-SJG_target.pdbqt | data/6W/6W39-SJG/6W39-SJG_decoys.pdbqt | data/6W/6W39-SJG/6W39-SJG_decoy_scores.csv |
6WA2-TOV | data/6W/6WA2-TOV/6WA2-TOV_ligand.pdbqt | data/6W/6WA2-TOV/6WA2-TOV_target.pdbqt | data/6W/6WA2-TOV/6WA2-TOV_decoys.pdbqt | data/6W/6WA2-TOV/6WA2-TOV_decoy_scores.csv |
6WI2-8Q1 | data/6W/6WI2-8Q1/6WI2-8Q1_ligand.pdbqt | data/6W/6WI2-8Q1/6WI2-8Q1_target.pdbqt | data/6W/6WI2-8Q1/6WI2-8Q1_decoys.pdbqt | data/6W/6WI2-8Q1/6WI2-8Q1_decoy_scores.csv |
6WBV-AGA | data/6W/6WBV-AGA/6WBV-AGA_ligand.pdbqt | data/6W/6WBV-AGA/6WBV-AGA_target.pdbqt | data/6W/6WBV-AGA/6WBV-AGA_decoys.pdbqt | data/6W/6WBV-AGA/6WBV-AGA_decoy_scores.csv |
6W8Z-TJD | data/6W/6W8Z-TJD/6W8Z-TJD_ligand.pdbqt | data/6W/6W8Z-TJD/6W8Z-TJD_target.pdbqt | data/6W/6W8Z-TJD/6W8Z-TJD_decoys.pdbqt | data/6W/6W8Z-TJD/6W8Z-TJD_decoy_scores.csv |
6WU8-U9Y | data/6W/6WU8-U9Y/6WU8-U9Y_ligand.pdbqt | data/6W/6WU8-U9Y/6WU8-U9Y_target.pdbqt | data/6W/6WU8-U9Y/6WU8-U9Y_decoys.pdbqt | data/6W/6WU8-U9Y/6WU8-U9Y_decoy_scores.csv |
6WOF-IHP | data/6W/6WOF-IHP/6WOF-IHP_ligand.pdbqt | data/6W/6WOF-IHP/6WOF-IHP_target.pdbqt | data/6W/6WOF-IHP/6WOF-IHP_decoys.pdbqt | data/6W/6WOF-IHP/6WOF-IHP_decoy_scores.csv |
6WYG-RFT | data/6W/6WYG-RFT/6WYG-RFT_ligand.pdbqt | data/6W/6WYG-RFT/6WYG-RFT_target.pdbqt | data/6W/6WYG-RFT/6WYG-RFT_decoys.pdbqt | data/6W/6WYG-RFT/6WYG-RFT_decoy_scores.csv |
6WRZ-SAH | data/6W/6WRZ-SAH/6WRZ-SAH_ligand.pdbqt | data/6W/6WRZ-SAH/6WRZ-SAH_target.pdbqt | data/6W/6WRZ-SAH/6WRZ-SAH_decoys.pdbqt | data/6W/6WRZ-SAH/6WRZ-SAH_decoy_scores.csv |
6WE7-TXM | data/6W/6WE7-TXM/6WE7-TXM_ligand.pdbqt | data/6W/6WE7-TXM/6WE7-TXM_target.pdbqt | data/6W/6WE7-TXM/6WE7-TXM_decoys.pdbqt | data/6W/6WE7-TXM/6WE7-TXM_decoy_scores.csv |
6W81-X77 | data/6W/6W81-X77/6W81-X77_ligand.pdbqt | data/6W/6W81-X77/6W81-X77_target.pdbqt | data/6W/6W81-X77/6W81-X77_decoys.pdbqt | data/6W/6W81-X77/6W81-X77_decoy_scores.csv |
6WQA-CLR | data/6W/6WQA-CLR/6WQA-CLR_ligand.pdbqt | data/6W/6WQA-CLR/6WQA-CLR_target.pdbqt | data/6W/6WQA-CLR/6WQA-CLR_decoys.pdbqt | data/6W/6WQA-CLR/6WQA-CLR_decoy_scores.csv |
6WTP-U8P | data/6W/6WTP-U8P/6WTP-U8P_ligand.pdbqt | data/6W/6WTP-U8P/6WTP-U8P_target.pdbqt | data/6W/6WTP-U8P/6WTP-U8P_decoys.pdbqt | data/6W/6WTP-U8P/6WTP-U8P_decoy_scores.csv |
6WV3-OLC | data/6W/6WV3-OLC/6WV3-OLC_ligand.pdbqt | data/6W/6WV3-OLC/6WV3-OLC_target.pdbqt | data/6W/6WV3-OLC/6WV3-OLC_decoys.pdbqt | data/6W/6WV3-OLC/6WV3-OLC_decoy_scores.csv |
6W4Y-7ZW | data/6W/6W4Y-7ZW/6W4Y-7ZW_ligand.pdbqt | data/6W/6W4Y-7ZW/6W4Y-7ZW_target.pdbqt | data/6W/6W4Y-7ZW/6W4Y-7ZW_decoys.pdbqt | data/6W/6W4Y-7ZW/6W4Y-7ZW_decoy_scores.csv |
6WIJ-QQ4 | data/6W/6WIJ-QQ4/6WIJ-QQ4_ligand.pdbqt | data/6W/6WIJ-QQ4/6WIJ-QQ4_target.pdbqt | data/6W/6WIJ-QQ4/6WIJ-QQ4_decoys.pdbqt | data/6W/6WIJ-QQ4/6WIJ-QQ4_decoy_scores.csv |
6W2L-IPE | data/6W/6W2L-IPE/6W2L-IPE_ligand.pdbqt | data/6W/6W2L-IPE/6W2L-IPE_target.pdbqt | data/6W/6W2L-IPE/6W2L-IPE_decoys.pdbqt | data/6W/6W2L-IPE/6W2L-IPE_decoy_scores.csv |
6WJO-TYR | data/6W/6WJO-TYR/6WJO-TYR_ligand.pdbqt | data/6W/6WJO-TYR/6WJO-TYR_target.pdbqt | data/6W/6WJO-TYR/6WJO-TYR_decoys.pdbqt | data/6W/6WJO-TYR/6WJO-TYR_decoy_scores.csv |
6W30-SJA | data/6W/6W30-SJA/6W30-SJA_ligand.pdbqt | data/6W/6W30-SJA/6W30-SJA_target.pdbqt | data/6W/6W30-SJA/6W30-SJA_decoys.pdbqt | data/6W/6W30-SJA/6W30-SJA_decoy_scores.csv |
6W7H-TEV | data/6W/6W7H-TEV/6W7H-TEV_ligand.pdbqt | data/6W/6W7H-TEV/6W7H-TEV_target.pdbqt | data/6W/6W7H-TEV/6W7H-TEV_decoys.pdbqt | data/6W/6W7H-TEV/6W7H-TEV_decoy_scores.csv |
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