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 ⌀ |
|---|---|---|---|---|
7ZD7-NAD | data/7Z/7ZD7-NAD/7ZD7-NAD_ligand.pdbqt | data/7Z/7ZD7-NAD/7ZD7-NAD_target.pdbqt | null | null |
7ZWT-K5U | data/7Z/7ZWT-K5U/7ZWT-K5U_ligand.pdbqt | data/7Z/7ZWT-K5U/7ZWT-K5U_target.pdbqt | data/7Z/7ZWT-K5U/7ZWT-K5U_decoys.pdbqt | data/7Z/7ZWT-K5U/7ZWT-K5U_decoy_scores.csv |
7ZD9-ADN | data/7Z/7ZD9-ADN/7ZD9-ADN_ligand.pdbqt | data/7Z/7ZD9-ADN/7ZD9-ADN_target.pdbqt | null | null |
7ZZJ-KIT | data/7Z/7ZZJ-KIT/7ZZJ-KIT_ligand.pdbqt | data/7Z/7ZZJ-KIT/7ZZJ-KIT_target.pdbqt | data/7Z/7ZZJ-KIT/7ZZJ-KIT_decoys.pdbqt | data/7Z/7ZZJ-KIT/7ZZJ-KIT_decoy_scores.csv |
7ZMH-ZMP | data/7Z/7ZMH-ZMP/7ZMH-ZMP_ligand.pdbqt | data/7Z/7ZMH-ZMP/7ZMH-ZMP_target.pdbqt | data/7Z/7ZMH-ZMP/7ZMH-ZMP_decoys.pdbqt | data/7Z/7ZMH-ZMP/7ZMH-ZMP_decoy_scores.csv |
7Z2P-ACP | data/7Z/7Z2P-ACP/7Z2P-ACP_ligand.pdbqt | data/7Z/7Z2P-ACP/7Z2P-ACP_target.pdbqt | data/7Z/7Z2P-ACP/7Z2P-ACP_decoys.pdbqt | data/7Z/7Z2P-ACP/7Z2P-ACP_decoy_scores.csv |
7ZGC-IUO | data/7Z/7ZGC-IUO/7ZGC-IUO_ligand.pdbqt | data/7Z/7ZGC-IUO/7ZGC-IUO_target.pdbqt | data/7Z/7ZGC-IUO/7ZGC-IUO_decoys.pdbqt | data/7Z/7ZGC-IUO/7ZGC-IUO_decoy_scores.csv |
7Z15-ATP | data/7Z/7Z15-ATP/7Z15-ATP_ligand.pdbqt | data/7Z/7Z15-ATP/7Z15-ATP_target.pdbqt | data/7Z/7Z15-ATP/7Z15-ATP_decoys.pdbqt | data/7Z/7Z15-ATP/7Z15-ATP_decoy_scores.csv |
7ZZ3-ADP | data/7Z/7ZZ3-ADP/7ZZ3-ADP_ligand.pdbqt | data/7Z/7ZZ3-ADP/7ZZ3-ADP_target.pdbqt | data/7Z/7ZZ3-ADP/7ZZ3-ADP_decoys.pdbqt | data/7Z/7ZZ3-ADP/7ZZ3-ADP_decoy_scores.csv |
7ZOY-LFA | data/7Z/7ZOY-LFA/7ZOY-LFA_ligand.pdbqt | data/7Z/7ZOY-LFA/7ZOY-LFA_target.pdbqt | data/7Z/7ZOY-LFA/7ZOY-LFA_decoys.pdbqt | data/7Z/7ZOY-LFA/7ZOY-LFA_decoy_scores.csv |
7Z2P-NW6 | data/7Z/7Z2P-NW6/7Z2P-NW6_ligand.pdbqt | data/7Z/7Z2P-NW6/7Z2P-NW6_target.pdbqt | data/7Z/7Z2P-NW6/7Z2P-NW6_decoys.pdbqt | data/7Z/7Z2P-NW6/7Z2P-NW6_decoy_scores.csv |
7ZQX-JU0 | data/7Z/7ZQX-JU0/7ZQX-JU0_ligand.pdbqt | data/7Z/7ZQX-JU0/7ZQX-JU0_target.pdbqt | data/7Z/7ZQX-JU0/7ZQX-JU0_decoys.pdbqt | data/7Z/7ZQX-JU0/7ZQX-JU0_decoy_scores.csv |
7ZQF-JW6 | data/7Z/7ZQF-JW6/7ZQF-JW6_ligand.pdbqt | data/7Z/7ZQF-JW6/7ZQF-JW6_target.pdbqt | data/7Z/7ZQF-JW6/7ZQF-JW6_decoys.pdbqt | data/7Z/7ZQF-JW6/7ZQF-JW6_decoy_scores.csv |
7ZWX-KA0 | data/7Z/7ZWX-KA0/7ZWX-KA0_ligand.pdbqt | data/7Z/7ZWX-KA0/7ZWX-KA0_target.pdbqt | data/7Z/7ZWX-KA0/7ZWX-KA0_decoys.pdbqt | data/7Z/7ZWX-KA0/7ZWX-KA0_decoy_scores.csv |
7ZOU-OLA | data/7Z/7ZOU-OLA/7ZOU-OLA_ligand.pdbqt | data/7Z/7ZOU-OLA/7ZOU-OLA_target.pdbqt | data/7Z/7ZOU-OLA/7ZOU-OLA_decoys.pdbqt | data/7Z/7ZOU-OLA/7ZOU-OLA_decoy_scores.csv |
7Z59-IFO | data/7Z/7Z59-IFO/7Z59-IFO_ligand.pdbqt | data/7Z/7Z59-IFO/7Z59-IFO_target.pdbqt | data/7Z/7Z59-IFO/7Z59-IFO_decoys.pdbqt | data/7Z/7Z59-IFO/7Z59-IFO_decoy_scores.csv |
7ZZW-KKW | data/7Z/7ZZW-KKW/7ZZW-KKW_ligand.pdbqt | data/7Z/7ZZW-KKW/7ZZW-KKW_target.pdbqt | data/7Z/7ZZW-KKW/7ZZW-KKW_decoys.pdbqt | data/7Z/7ZZW-KKW/7ZZW-KKW_decoy_scores.csv |
7ZEJ-CEL | data/7Z/7ZEJ-CEL/7ZEJ-CEL_ligand.pdbqt | data/7Z/7ZEJ-CEL/7ZEJ-CEL_target.pdbqt | data/7Z/7ZEJ-CEL/7ZEJ-CEL_decoys.pdbqt | data/7Z/7ZEJ-CEL/7ZEJ-CEL_decoy_scores.csv |
7Z54-OYT | data/7Z/7Z54-OYT/7Z54-OYT_ligand.pdbqt | data/7Z/7Z54-OYT/7Z54-OYT_target.pdbqt | data/7Z/7Z54-OYT/7Z54-OYT_decoys.pdbqt | data/7Z/7Z54-OYT/7Z54-OYT_decoy_scores.csv |
7Z5X-AWJ | data/7Z/7Z5X-AWJ/7Z5X-AWJ_ligand.pdbqt | data/7Z/7Z5X-AWJ/7Z5X-AWJ_target.pdbqt | data/7Z/7Z5X-AWJ/7Z5X-AWJ_decoys.pdbqt | data/7Z/7Z5X-AWJ/7Z5X-AWJ_decoy_scores.csv |
7ZTX-DHT | data/7Z/7ZTX-DHT/7ZTX-DHT_ligand.pdbqt | data/7Z/7ZTX-DHT/7ZTX-DHT_target.pdbqt | data/7Z/7ZTX-DHT/7ZTX-DHT_decoys.pdbqt | data/7Z/7ZTX-DHT/7ZTX-DHT_decoy_scores.csv |
7ZIZ-IYL | data/7Z/7ZIZ-IYL/7ZIZ-IYL_ligand.pdbqt | data/7Z/7ZIZ-IYL/7ZIZ-IYL_target.pdbqt | data/7Z/7ZIZ-IYL/7ZIZ-IYL_decoys.pdbqt | data/7Z/7ZIZ-IYL/7ZIZ-IYL_decoy_scores.csv |
7Z2J-SAH | data/7Z/7Z2J-SAH/7Z2J-SAH_ligand.pdbqt | data/7Z/7Z2J-SAH/7Z2J-SAH_target.pdbqt | data/7Z/7Z2J-SAH/7Z2J-SAH_decoys.pdbqt | data/7Z/7Z2J-SAH/7Z2J-SAH_decoy_scores.csv |
7ZPC-JLC | data/7Z/7ZPC-JLC/7ZPC-JLC_ligand.pdbqt | data/7Z/7ZPC-JLC/7ZPC-JLC_target.pdbqt | data/7Z/7ZPC-JLC/7ZPC-JLC_decoys.pdbqt | data/7Z/7ZPC-JLC/7ZPC-JLC_decoy_scores.csv |
7ZD7-ADN | data/7Z/7ZD7-ADN/7ZD7-ADN_ligand.pdbqt | data/7Z/7ZD7-ADN/7ZD7-ADN_target.pdbqt | null | null |
7Z57-IGB | data/7Z/7Z57-IGB/7Z57-IGB_ligand.pdbqt | data/7Z/7Z57-IGB/7Z57-IGB_target.pdbqt | data/7Z/7Z57-IGB/7Z57-IGB_decoys.pdbqt | data/7Z/7Z57-IGB/7Z57-IGB_decoy_scores.csv |
7Z0F-GDP | data/7Z/7Z0F-GDP/7Z0F-GDP_ligand.pdbqt | data/7Z/7Z0F-GDP/7Z0F-GDP_target.pdbqt | data/7Z/7Z0F-GDP/7Z0F-GDP_decoys.pdbqt | data/7Z/7Z0F-GDP/7Z0F-GDP_decoy_scores.csv |
7ZZ3-ATP | data/7Z/7ZZ3-ATP/7ZZ3-ATP_ligand.pdbqt | data/7Z/7ZZ3-ATP/7ZZ3-ATP_target.pdbqt | data/7Z/7ZZ3-ATP/7ZZ3-ATP_decoys.pdbqt | data/7Z/7ZZ3-ATP/7ZZ3-ATP_decoy_scores.csv |
7ZWV-KA9 | data/7Z/7ZWV-KA9/7ZWV-KA9_ligand.pdbqt | data/7Z/7ZWV-KA9/7ZWV-KA9_target.pdbqt | data/7Z/7ZWV-KA9/7ZWV-KA9_decoys.pdbqt | data/7Z/7ZWV-KA9/7ZWV-KA9_decoy_scores.csv |
7ZUY-MTA | data/7Z/7ZUY-MTA/7ZUY-MTA_ligand.pdbqt | data/7Z/7ZUY-MTA/7ZUY-MTA_target.pdbqt | data/7Z/7ZUY-MTA/7ZUY-MTA_decoys.pdbqt | data/7Z/7ZUY-MTA/7ZUY-MTA_decoy_scores.csv |
7ZTL-ADP | data/7Z/7ZTL-ADP/7ZTL-ADP_ligand.pdbqt | data/7Z/7ZTL-ADP/7ZTL-ADP_target.pdbqt | data/7Z/7ZTL-ADP/7ZTL-ADP_decoys.pdbqt | data/7Z/7ZTL-ADP/7ZTL-ADP_decoy_scores.csv |
7ZER-UDP | data/7Z/7ZER-UDP/7ZER-UDP_ligand.pdbqt | data/7Z/7ZER-UDP/7ZER-UDP_target.pdbqt | data/7Z/7ZER-UDP/7ZER-UDP_decoys.pdbqt | data/7Z/7ZER-UDP/7ZER-UDP_decoy_scores.csv |
7ZWS-K5I | data/7Z/7ZWS-K5I/7ZWS-K5I_ligand.pdbqt | data/7Z/7ZWS-K5I/7ZWS-K5I_target.pdbqt | data/7Z/7ZWS-K5I/7ZWS-K5I_decoys.pdbqt | data/7Z/7ZWS-K5I/7ZWS-K5I_decoy_scores.csv |
7Z01-GTP | data/7Z/7Z01-GTP/7Z01-GTP_ligand.pdbqt | data/7Z/7Z01-GTP/7Z01-GTP_target.pdbqt | data/7Z/7Z01-GTP/7Z01-GTP_decoys.pdbqt | data/7Z/7Z01-GTP/7Z01-GTP_decoy_scores.csv |
7Z02-GDP | data/7Z/7Z02-GDP/7Z02-GDP_ligand.pdbqt | data/7Z/7Z02-GDP/7Z02-GDP_target.pdbqt | data/7Z/7Z02-GDP/7Z02-GDP_decoys.pdbqt | data/7Z/7Z02-GDP/7Z02-GDP_decoy_scores.csv |
7Z7S-NAI | data/7Z/7Z7S-NAI/7Z7S-NAI_ligand.pdbqt | data/7Z/7Z7S-NAI/7Z7S-NAI_target.pdbqt | data/7Z/7Z7S-NAI/7Z7S-NAI_decoys.pdbqt | data/7Z/7Z7S-NAI/7Z7S-NAI_decoy_scores.csv |
7ZO7-JOU | data/7Z/7ZO7-JOU/7ZO7-JOU_ligand.pdbqt | data/7Z/7ZO7-JOU/7ZO7-JOU_target.pdbqt | data/7Z/7ZO7-JOU/7ZO7-JOU_decoys.pdbqt | data/7Z/7ZO7-JOU/7ZO7-JOU_decoy_scores.csv |
7Z0W-FMN | data/7Z/7Z0W-FMN/7Z0W-FMN_ligand.pdbqt | data/7Z/7Z0W-FMN/7Z0W-FMN_target.pdbqt | data/7Z/7Z0W-FMN/7Z0W-FMN_decoys.pdbqt | data/7Z/7Z0W-FMN/7Z0W-FMN_decoy_scores.csv |
7Z2S-IHS | data/7Z/7Z2S-IHS/7Z2S-IHS_ligand.pdbqt | data/7Z/7Z2S-IHS/7Z2S-IHS_target.pdbqt | data/7Z/7Z2S-IHS/7Z2S-IHS_decoys.pdbqt | data/7Z/7Z2S-IHS/7Z2S-IHS_decoy_scores.csv |
7ZYR-ATP | data/7Z/7ZYR-ATP/7ZYR-ATP_ligand.pdbqt | data/7Z/7ZYR-ATP/7ZYR-ATP_target.pdbqt | data/7Z/7ZYR-ATP/7ZYR-ATP_decoys.pdbqt | data/7Z/7ZYR-ATP/7ZYR-ATP_decoy_scores.csv |
7ZO6-JNX | data/7Z/7ZO6-JNX/7ZO6-JNX_ligand.pdbqt | data/7Z/7ZO6-JNX/7ZO6-JNX_target.pdbqt | data/7Z/7ZO6-JNX/7ZO6-JNX_decoys.pdbqt | data/7Z/7ZO6-JNX/7ZO6-JNX_decoy_scores.csv |
7Z3E-FNR | data/7Z/7Z3E-FNR/7Z3E-FNR_ligand.pdbqt | data/7Z/7Z3E-FNR/7Z3E-FNR_target.pdbqt | data/7Z/7Z3E-FNR/7Z3E-FNR_decoys.pdbqt | data/7Z/7Z3E-FNR/7Z3E-FNR_decoy_scores.csv |
7ZOG-LYS | data/7Z/7ZOG-LYS/7ZOG-LYS_ligand.pdbqt | data/7Z/7ZOG-LYS/7ZOG-LYS_target.pdbqt | data/7Z/7ZOG-LYS/7ZOG-LYS_decoys.pdbqt | data/7Z/7ZOG-LYS/7ZOG-LYS_decoy_scores.csv |
7ZZO-KIZ | data/7Z/7ZZO-KIZ/7ZZO-KIZ_ligand.pdbqt | data/7Z/7ZZO-KIZ/7ZZO-KIZ_target.pdbqt | data/7Z/7ZZO-KIZ/7ZZO-KIZ_decoys.pdbqt | data/7Z/7ZZO-KIZ/7ZZO-KIZ_decoy_scores.csv |
7Z7V-LFA | data/7Z/7Z7V-LFA/7Z7V-LFA_ligand.pdbqt | data/7Z/7Z7V-LFA/7Z7V-LFA_target.pdbqt | data/7Z/7Z7V-LFA/7Z7V-LFA_decoys.pdbqt | data/7Z/7Z7V-LFA/7Z7V-LFA_decoy_scores.csv |
7ZZS-SHH | data/7Z/7ZZS-SHH/7ZZS-SHH_ligand.pdbqt | data/7Z/7ZZS-SHH/7ZZS-SHH_target.pdbqt | data/7Z/7ZZS-SHH/7ZZS-SHH_decoys.pdbqt | data/7Z/7ZZS-SHH/7ZZS-SHH_decoy_scores.csv |
7ZIG-IVZ | data/7Z/7ZIG-IVZ/7ZIG-IVZ_ligand.pdbqt | data/7Z/7ZIG-IVZ/7ZIG-IVZ_target.pdbqt | data/7Z/7ZIG-IVZ/7ZIG-IVZ_decoys.pdbqt | data/7Z/7ZIG-IVZ/7ZIG-IVZ_decoy_scores.csv |
7ZXZ-K9R | data/7Z/7ZXZ-K9R/7ZXZ-K9R_ligand.pdbqt | data/7Z/7ZXZ-K9R/7ZXZ-K9R_target.pdbqt | data/7Z/7ZXZ-K9R/7ZXZ-K9R_decoys.pdbqt | data/7Z/7ZXZ-K9R/7ZXZ-K9R_decoy_scores.csv |
7Z3J-I3P | data/7Z/7Z3J-I3P/7Z3J-I3P_ligand.pdbqt | data/7Z/7Z3J-I3P/7Z3J-I3P_target.pdbqt | data/7Z/7Z3J-I3P/7Z3J-I3P_decoys.pdbqt | data/7Z/7Z3J-I3P/7Z3J-I3P_decoy_scores.csv |
7Z7B-OYK | data/7Z/7Z7B-OYK/7Z7B-OYK_ligand.pdbqt | data/7Z/7Z7B-OYK/7Z7B-OYK_target.pdbqt | data/7Z/7Z7B-OYK/7Z7B-OYK_decoys.pdbqt | data/7Z/7Z7B-OYK/7Z7B-OYK_decoy_scores.csv |
7ZPG-JQX | data/7Z/7ZPG-JQX/7ZPG-JQX_ligand.pdbqt | data/7Z/7ZPG-JQX/7ZPG-JQX_target.pdbqt | data/7Z/7ZPG-JQX/7ZPG-JQX_decoys.pdbqt | data/7Z/7ZPG-JQX/7ZPG-JQX_decoy_scores.csv |
7ZFM-P6G | data/7Z/7ZFM-P6G/7ZFM-P6G_ligand.pdbqt | data/7Z/7ZFM-P6G/7ZFM-P6G_target.pdbqt | data/7Z/7ZFM-P6G/7ZFM-P6G_decoys.pdbqt | data/7Z/7ZFM-P6G/7ZFM-P6G_decoy_scores.csv |
7ZU2-DHT | data/7Z/7ZU2-DHT/7ZU2-DHT_ligand.pdbqt | data/7Z/7ZU2-DHT/7ZU2-DHT_target.pdbqt | data/7Z/7ZU2-DHT/7ZU2-DHT_decoys.pdbqt | data/7Z/7ZU2-DHT/7ZU2-DHT_decoy_scores.csv |
7ZSG-45D | data/7Z/7ZSG-45D/7ZSG-45D_ligand.pdbqt | data/7Z/7ZSG-45D/7ZSG-45D_target.pdbqt | data/7Z/7ZSG-45D/7ZSG-45D_decoys.pdbqt | data/7Z/7ZSG-45D/7ZSG-45D_decoy_scores.csv |
8NSE-H4B | data/8N/8NSE-H4B/8NSE-H4B_ligand.pdbqt | data/8N/8NSE-H4B/8NSE-H4B_target.pdbqt | null | null |
8NSE-NRG | data/8N/8NSE-NRG/8NSE-NRG_ligand.pdbqt | data/8N/8NSE-NRG/8NSE-NRG_target.pdbqt | null | null |
966C-RS2 | data/96/966C-RS2/966C-RS2_ligand.pdbqt | data/96/966C-RS2/966C-RS2_target.pdbqt | data/96/966C-RS2/966C-RS2_decoys.pdbqt | data/96/966C-RS2/966C-RS2_decoy_scores.csv |
1N95-HFP | data/1N/1N95-HFP/1N95-HFP_ligand.pdbqt | data/1N/1N95-HFP/1N95-HFP_target.pdbqt | data/1N/1N95-HFP/1N95-HFP_decoys.pdbqt | data/1N/1N95-HFP/1N95-HFP_decoy_scores.csv |
1NV4-F6P | data/1N/1NV4-F6P/1NV4-F6P_ligand.pdbqt | data/1N/1NV4-F6P/1NV4-F6P_target.pdbqt | null | null |
1NIU-DCS | data/1N/1NIU-DCS/1NIU-DCS_ligand.pdbqt | data/1N/1NIU-DCS/1NIU-DCS_target.pdbqt | data/1N/1NIU-DCS/1NIU-DCS_decoys.pdbqt | data/1N/1NIU-DCS/1NIU-DCS_decoy_scores.csv |
1NN3-ADP | data/1N/1NN3-ADP/1NN3-ADP_ligand.pdbqt | data/1N/1NN3-ADP/1NN3-ADP_target.pdbqt | data/1N/1NN3-ADP/1NN3-ADP_decoys.pdbqt | data/1N/1NN3-ADP/1NN3-ADP_decoy_scores.csv |
1NW3-SAM | data/1N/1NW3-SAM/1NW3-SAM_ligand.pdbqt | data/1N/1NW3-SAM/1NW3-SAM_target.pdbqt | data/1N/1NW3-SAM/1NW3-SAM_decoys.pdbqt | data/1N/1NW3-SAM/1NW3-SAM_decoy_scores.csv |
1N3Z-ADN | data/1N/1N3Z-ADN/1N3Z-ADN_ligand.pdbqt | data/1N/1N3Z-ADN/1N3Z-ADN_target.pdbqt | data/1N/1N3Z-ADN/1N3Z-ADN_decoys.pdbqt | data/1N/1N3Z-ADN/1N3Z-ADN_decoy_scores.csv |
1N5K-TMP | data/1N/1N5K-TMP/1N5K-TMP_ligand.pdbqt | data/1N/1N5K-TMP/1N5K-TMP_target.pdbqt | data/1N/1N5K-TMP/1N5K-TMP_decoys.pdbqt | data/1N/1N5K-TMP/1N5K-TMP_decoy_scores.csv |
1NGB-ADP | data/1N/1NGB-ADP/1NGB-ADP_ligand.pdbqt | data/1N/1NGB-ADP/1NGB-ADP_target.pdbqt | data/1N/1NGB-ADP/1NGB-ADP_decoys.pdbqt | data/1N/1NGB-ADP/1NGB-ADP_decoy_scores.csv |
1NS7-BGC | data/1N/1NS7-BGC/1NS7-BGC_ligand.pdbqt | data/1N/1NS7-BGC/1NS7-BGC_target.pdbqt | data/1N/1NS7-BGC/1NS7-BGC_decoys.pdbqt | data/1N/1NS7-BGC/1NS7-BGC_decoy_scores.csv |
1NEC-FMN | data/1N/1NEC-FMN/1NEC-FMN_ligand.pdbqt | data/1N/1NEC-FMN/1NEC-FMN_target.pdbqt | data/1N/1NEC-FMN/1NEC-FMN_decoys.pdbqt | data/1N/1NEC-FMN/1NEC-FMN_decoy_scores.csv |
1NFS-DED | data/1N/1NFS-DED/1NFS-DED_ligand.pdbqt | data/1N/1NFS-DED/1NFS-DED_target.pdbqt | data/1N/1NFS-DED/1NFS-DED_decoys.pdbqt | data/1N/1NFS-DED/1NFS-DED_decoy_scores.csv |
1NOJ-NTZ | data/1N/1NOJ-NTZ/1NOJ-NTZ_ligand.pdbqt | data/1N/1NOJ-NTZ/1NOJ-NTZ_target.pdbqt | data/1N/1NOJ-NTZ/1NOJ-NTZ_decoys.pdbqt | data/1N/1NOJ-NTZ/1NOJ-NTZ_decoy_scores.csv |
1NFY-RTR | data/1N/1NFY-RTR/1NFY-RTR_ligand.pdbqt | data/1N/1NFY-RTR/1NFY-RTR_target.pdbqt | data/1N/1NFY-RTR/1NFY-RTR_decoys.pdbqt | data/1N/1NFY-RTR/1NFY-RTR_decoy_scores.csv |
1NYW-DAU | data/1N/1NYW-DAU/1NYW-DAU_ligand.pdbqt | data/1N/1NYW-DAU/1NYW-DAU_target.pdbqt | data/1N/1NYW-DAU/1NYW-DAU_decoys.pdbqt | data/1N/1NYW-DAU/1NYW-DAU_decoy_scores.csv |
1NAA-ABL | data/1N/1NAA-ABL/1NAA-ABL_ligand.pdbqt | data/1N/1NAA-ABL/1NAA-ABL_target.pdbqt | data/1N/1NAA-ABL/1NAA-ABL_decoys.pdbqt | data/1N/1NAA-ABL/1NAA-ABL_decoy_scores.csv |
1NSF-ATP | data/1N/1NSF-ATP/1NSF-ATP_ligand.pdbqt | data/1N/1NSF-ATP/1NSF-ATP_target.pdbqt | data/1N/1NSF-ATP/1NSF-ATP_decoys.pdbqt | data/1N/1NSF-ATP/1NSF-ATP_decoy_scores.csv |
1NCE-CB3 | data/1N/1NCE-CB3/1NCE-CB3_ligand.pdbqt | data/1N/1NCE-CB3/1NCE-CB3_target.pdbqt | data/1N/1NCE-CB3/1NCE-CB3_decoys.pdbqt | data/1N/1NCE-CB3/1NCE-CB3_decoy_scores.csv |
1N9B-MA4 | data/1N/1N9B-MA4/1N9B-MA4_ligand.pdbqt | data/1N/1N9B-MA4/1N9B-MA4_target.pdbqt | data/1N/1N9B-MA4/1N9B-MA4_decoys.pdbqt | data/1N/1N9B-MA4/1N9B-MA4_decoy_scores.csv |
1NHG-NAD | data/1N/1NHG-NAD/1NHG-NAD_ligand.pdbqt | data/1N/1NHG-NAD/1NHG-NAD_target.pdbqt | data/1N/1NHG-NAD/1NHG-NAD_decoys.pdbqt | data/1N/1NHG-NAD/1NHG-NAD_decoy_scores.csv |
1N6K-GDP | data/1N/1N6K-GDP/1N6K-GDP_ligand.pdbqt | data/1N/1N6K-GDP/1N6K-GDP_target.pdbqt | null | null |
1NAS-ASE | data/1N/1NAS-ASE/1NAS-ASE_ligand.pdbqt | data/1N/1NAS-ASE/1NAS-ASE_target.pdbqt | data/1N/1NAS-ASE/1NAS-ASE_decoys.pdbqt | data/1N/1NAS-ASE/1NAS-ASE_decoy_scores.csv |
1NWK-RHO | data/1N/1NWK-RHO/1NWK-RHO_ligand.pdbqt | data/1N/1NWK-RHO/1NWK-RHO_target.pdbqt | data/1N/1NWK-RHO/1NWK-RHO_decoys.pdbqt | data/1N/1NWK-RHO/1NWK-RHO_decoy_scores.csv |
1NL9-989 | data/1N/1NL9-989/1NL9-989_ligand.pdbqt | data/1N/1NL9-989/1NL9-989_target.pdbqt | data/1N/1NL9-989/1NL9-989_decoys.pdbqt | data/1N/1NL9-989/1NL9-989_decoy_scores.csv |
1NMX-FDM | data/1N/1NMX-FDM/1NMX-FDM_ligand.pdbqt | data/1N/1NMX-FDM/1NMX-FDM_target.pdbqt | data/1N/1NMX-FDM/1NMX-FDM_decoys.pdbqt | data/1N/1NMX-FDM/1NMX-FDM_decoy_scores.csv |
1NPZ-C1P | data/1N/1NPZ-C1P/1NPZ-C1P_ligand.pdbqt | data/1N/1NPZ-C1P/1NPZ-C1P_target.pdbqt | data/1N/1NPZ-C1P/1NPZ-C1P_decoys.pdbqt | data/1N/1NPZ-C1P/1NPZ-C1P_decoy_scores.csv |
1NN3-2DT | data/1N/1NN3-2DT/1NN3-2DT_ligand.pdbqt | data/1N/1NN3-2DT/1NN3-2DT_target.pdbqt | data/1N/1NN3-2DT/1NN3-2DT_decoys.pdbqt | data/1N/1NN3-2DT/1NN3-2DT_decoy_scores.csv |
1NNP-CE2 | data/1N/1NNP-CE2/1NNP-CE2_ligand.pdbqt | data/1N/1NNP-CE2/1NNP-CE2_target.pdbqt | data/1N/1NNP-CE2/1NNP-CE2_decoys.pdbqt | data/1N/1NNP-CE2/1NNP-CE2_decoy_scores.csv |
1NB0-ADP | data/1N/1NB0-ADP/1NB0-ADP_ligand.pdbqt | data/1N/1NB0-ADP/1NB0-ADP_target.pdbqt | data/1N/1NB0-ADP/1NB0-ADP_decoys.pdbqt | data/1N/1NB0-ADP/1NB0-ADP_decoy_scores.csv |
1NDJ-BTN | data/1N/1NDJ-BTN/1NDJ-BTN_ligand.pdbqt | data/1N/1NDJ-BTN/1NDJ-BTN_target.pdbqt | data/1N/1NDJ-BTN/1NDJ-BTN_decoys.pdbqt | data/1N/1NDJ-BTN/1NDJ-BTN_decoy_scores.csv |
1N2A-GTS | data/1N/1N2A-GTS/1N2A-GTS_ligand.pdbqt | data/1N/1N2A-GTS/1N2A-GTS_target.pdbqt | data/1N/1N2A-GTS/1N2A-GTS_decoys.pdbqt | data/1N/1N2A-GTS/1N2A-GTS_decoy_scores.csv |
1NDZ-FR5 | data/1N/1NDZ-FR5/1NDZ-FR5_ligand.pdbqt | data/1N/1NDZ-FR5/1NDZ-FR5_target.pdbqt | data/1N/1NDZ-FR5/1NDZ-FR5_decoys.pdbqt | data/1N/1NDZ-FR5/1NDZ-FR5_decoy_scores.csv |
1NGJ-ANP | data/1N/1NGJ-ANP/1NGJ-ANP_ligand.pdbqt | data/1N/1NGJ-ANP/1NGJ-ANP_target.pdbqt | data/1N/1NGJ-ANP/1NGJ-ANP_decoys.pdbqt | data/1N/1NGJ-ANP/1NGJ-ANP_decoy_scores.csv |
1N2N-H4B | data/1N/1N2N-H4B/1N2N-H4B_ligand.pdbqt | data/1N/1N2N-H4B/1N2N-H4B_target.pdbqt | data/1N/1N2N-H4B/1N2N-H4B_decoys.pdbqt | data/1N/1N2N-H4B/1N2N-H4B_decoy_scores.csv |
1NPT-NAD | data/1N/1NPT-NAD/1NPT-NAD_ligand.pdbqt | data/1N/1NPT-NAD/1NPT-NAD_target.pdbqt | data/1N/1NPT-NAD/1NPT-NAD_decoys.pdbqt | data/1N/1NPT-NAD/1NPT-NAD_decoy_scores.csv |
1NWZ-HC4 | data/1N/1NWZ-HC4/1NWZ-HC4_ligand.pdbqt | data/1N/1NWZ-HC4/1NWZ-HC4_target.pdbqt | data/1N/1NWZ-HC4/1NWZ-HC4_decoys.pdbqt | data/1N/1NWZ-HC4/1NWZ-HC4_decoy_scores.csv |
1N9L-FMN | data/1N/1N9L-FMN/1N9L-FMN_ligand.pdbqt | data/1N/1N9L-FMN/1N9L-FMN_target.pdbqt | data/1N/1N9L-FMN/1N9L-FMN_decoys.pdbqt | data/1N/1N9L-FMN/1N9L-FMN_decoy_scores.csv |
1NQO-NAD | data/1N/1NQO-NAD/1NQO-NAD_ligand.pdbqt | data/1N/1NQO-NAD/1NQO-NAD_target.pdbqt | data/1N/1NQO-NAD/1NQO-NAD_decoys.pdbqt | data/1N/1NQO-NAD/1NQO-NAD_decoy_scores.csv |
1NST-A3P | data/1N/1NST-A3P/1NST-A3P_ligand.pdbqt | data/1N/1NST-A3P/1NST-A3P_target.pdbqt | data/1N/1NST-A3P/1NST-A3P_decoys.pdbqt | data/1N/1NST-A3P/1NST-A3P_decoy_scores.csv |
1NMY-ADP | data/1N/1NMY-ADP/1NMY-ADP_ligand.pdbqt | data/1N/1NMY-ADP/1NMY-ADP_target.pdbqt | data/1N/1NMY-ADP/1NMY-ADP_decoys.pdbqt | data/1N/1NMY-ADP/1NMY-ADP_decoy_scores.csv |
1N6O-GNP | data/1N/1N6O-GNP/1N6O-GNP_ligand.pdbqt | data/1N/1N6O-GNP/1N6O-GNP_target.pdbqt | data/1N/1N6O-GNP/1N6O-GNP_decoys.pdbqt | data/1N/1N6O-GNP/1N6O-GNP_decoy_scores.csv |
1NCO-CHR | data/1N/1NCO-CHR/1NCO-CHR_ligand.pdbqt | data/1N/1NCO-CHR/1NCO-CHR_target.pdbqt | data/1N/1NCO-CHR/1NCO-CHR_decoys.pdbqt | data/1N/1NCO-CHR/1NCO-CHR_decoy_scores.csv |
1NUT-APC | data/1N/1NUT-APC/1NUT-APC_ligand.pdbqt | data/1N/1NUT-APC/1NUT-APC_target.pdbqt | data/1N/1NUT-APC/1NUT-APC_decoys.pdbqt | data/1N/1NUT-APC/1NUT-APC_decoy_scores.csv |
1NV0-F6P | data/1N/1NV0-F6P/1NV0-F6P_ligand.pdbqt | data/1N/1NV0-F6P/1NV0-F6P_target.pdbqt | null | null |
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