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 ⌀ |
|---|---|---|---|---|
2I16-LDT | data/2I/2I16-LDT/2I16-LDT_ligand.pdbqt | data/2I/2I16-LDT/2I16-LDT_target.pdbqt | data/2I/2I16-LDT/2I16-LDT_decoys.pdbqt | data/2I/2I16-LDT/2I16-LDT_decoy_scores.csv |
2I66-G2R | data/2I/2I66-G2R/2I66-G2R_ligand.pdbqt | data/2I/2I66-G2R/2I66-G2R_target.pdbqt | data/2I/2I66-G2R/2I66-G2R_decoys.pdbqt | data/2I/2I66-G2R/2I66-G2R_decoy_scores.csv |
2IWT-FLC | data/2I/2IWT-FLC/2IWT-FLC_ligand.pdbqt | data/2I/2IWT-FLC/2IWT-FLC_target.pdbqt | data/2I/2IWT-FLC/2IWT-FLC_decoys.pdbqt | data/2I/2IWT-FLC/2IWT-FLC_decoy_scores.csv |
2IOR-ADP | data/2I/2IOR-ADP/2IOR-ADP_ligand.pdbqt | data/2I/2IOR-ADP/2IOR-ADP_target.pdbqt | data/2I/2IOR-ADP/2IOR-ADP_decoys.pdbqt | data/2I/2IOR-ADP/2IOR-ADP_decoy_scores.csv |
2I51-FMN | data/2I/2I51-FMN/2I51-FMN_ligand.pdbqt | data/2I/2I51-FMN/2I51-FMN_target.pdbqt | data/2I/2I51-FMN/2I51-FMN_decoys.pdbqt | data/2I/2I51-FMN/2I51-FMN_decoy_scores.csv |
2IYA-ZIO | data/2I/2IYA-ZIO/2IYA-ZIO_ligand.pdbqt | data/2I/2IYA-ZIO/2IYA-ZIO_target.pdbqt | data/2I/2IYA-ZIO/2IYA-ZIO_decoys.pdbqt | data/2I/2IYA-ZIO/2IYA-ZIO_decoy_scores.csv |
2I67-APR | data/2I/2I67-APR/2I67-APR_ligand.pdbqt | data/2I/2I67-APR/2I67-APR_target.pdbqt | data/2I/2I67-APR/2I67-APR_decoys.pdbqt | data/2I/2I67-APR/2I67-APR_decoy_scores.csv |
2IRV-LDA | data/2I/2IRV-LDA/2IRV-LDA_ligand.pdbqt | data/2I/2IRV-LDA/2IRV-LDA_target.pdbqt | data/2I/2IRV-LDA/2IRV-LDA_decoys.pdbqt | data/2I/2IRV-LDA/2IRV-LDA_decoy_scores.csv |
2IDW-017 | data/2I/2IDW-017/2IDW-017_ligand.pdbqt | data/2I/2IDW-017/2IDW-017_target.pdbqt | data/2I/2IDW-017/2IDW-017_decoys.pdbqt | data/2I/2IDW-017/2IDW-017_decoy_scores.csv |
2IU8-UD1 | data/2I/2IU8-UD1/2IU8-UD1_ligand.pdbqt | data/2I/2IU8-UD1/2IU8-UD1_target.pdbqt | data/2I/2IU8-UD1/2IU8-UD1_decoys.pdbqt | data/2I/2IU8-UD1/2IU8-UD1_decoy_scores.csv |
2IXH-TRH | data/2I/2IXH-TRH/2IXH-TRH_ligand.pdbqt | data/2I/2IXH-TRH/2IXH-TRH_target.pdbqt | data/2I/2IXH-TRH/2IXH-TRH_decoys.pdbqt | data/2I/2IXH-TRH/2IXH-TRH_decoy_scores.csv |
2I2F-NAD | data/2I/2I2F-NAD/2I2F-NAD_ligand.pdbqt | data/2I/2I2F-NAD/2I2F-NAD_target.pdbqt | data/2I/2I2F-NAD/2I2F-NAD_decoys.pdbqt | data/2I/2I2F-NAD/2I2F-NAD_decoy_scores.csv |
2I10-NPO | data/2I/2I10-NPO/2I10-NPO_ligand.pdbqt | data/2I/2I10-NPO/2I10-NPO_target.pdbqt | data/2I/2I10-NPO/2I10-NPO_decoys.pdbqt | data/2I/2I10-NPO/2I10-NPO_decoy_scores.csv |
2IOK-IOK | data/2I/2IOK-IOK/2IOK-IOK_ligand.pdbqt | data/2I/2IOK-IOK/2IOK-IOK_target.pdbqt | data/2I/2IOK-IOK/2IOK-IOK_decoys.pdbqt | data/2I/2IOK-IOK/2IOK-IOK_decoy_scores.csv |
2IYX-SKM | data/2I/2IYX-SKM/2IYX-SKM_ligand.pdbqt | data/2I/2IYX-SKM/2IYX-SKM_target.pdbqt | data/2I/2IYX-SKM/2IYX-SKM_decoys.pdbqt | data/2I/2IYX-SKM/2IYX-SKM_decoy_scores.csv |
2IZS-BRQ | data/2I/2IZS-BRQ/2IZS-BRQ_ligand.pdbqt | data/2I/2IZS-BRQ/2IZS-BRQ_target.pdbqt | data/2I/2IZS-BRQ/2IZS-BRQ_decoys.pdbqt | data/2I/2IZS-BRQ/2IZS-BRQ_decoy_scores.csv |
2IPG-FFA | data/2I/2IPG-FFA/2IPG-FFA_ligand.pdbqt | data/2I/2IPG-FFA/2IPG-FFA_target.pdbqt | data/2I/2IPG-FFA/2IPG-FFA_decoys.pdbqt | data/2I/2IPG-FFA/2IPG-FFA_decoy_scores.csv |
2I65-NAD | data/2I/2I65-NAD/2I65-NAD_ligand.pdbqt | data/2I/2I65-NAD/2I65-NAD_target.pdbqt | data/2I/2I65-NAD/2I65-NAD_decoys.pdbqt | data/2I/2I65-NAD/2I65-NAD_decoy_scores.csv |
2I1X-RET | data/2I/2I1X-RET/2I1X-RET_ligand.pdbqt | data/2I/2I1X-RET/2I1X-RET_target.pdbqt | data/2I/2I1X-RET/2I1X-RET_decoys.pdbqt | data/2I/2I1X-RET/2I1X-RET_decoy_scores.csv |
2IW6-QQ2 | data/2I/2IW6-QQ2/2IW6-QQ2_ligand.pdbqt | data/2I/2IW6-QQ2/2IW6-QQ2_target.pdbqt | data/2I/2IW6-QQ2/2IW6-QQ2_decoys.pdbqt | data/2I/2IW6-QQ2/2IW6-QQ2_decoy_scores.csv |
2IZ1-ATR | data/2I/2IZ1-ATR/2IZ1-ATR_ligand.pdbqt | data/2I/2IZ1-ATR/2IZ1-ATR_target.pdbqt | data/2I/2IZ1-ATR/2IZ1-ATR_decoys.pdbqt | data/2I/2IZ1-ATR/2IZ1-ATR_decoy_scores.csv |
2IVS-ACK | data/2I/2IVS-ACK/2IVS-ACK_ligand.pdbqt | data/2I/2IVS-ACK/2IVS-ACK_target.pdbqt | data/2I/2IVS-ACK/2IVS-ACK_decoys.pdbqt | data/2I/2IVS-ACK/2IVS-ACK_decoy_scores.csv |
2IKI-388 | data/2I/2IKI-388/2IKI-388_ligand.pdbqt | data/2I/2IKI-388/2IKI-388_target.pdbqt | data/2I/2IKI-388/2IKI-388_decoys.pdbqt | data/2I/2IKI-388/2IKI-388_decoy_scores.csv |
2I47-KGY | data/2I/2I47-KGY/2I47-KGY_ligand.pdbqt | data/2I/2I47-KGY/2I47-KGY_target.pdbqt | data/2I/2I47-KGY/2I47-KGY_decoys.pdbqt | data/2I/2I47-KGY/2I47-KGY_decoy_scores.csv |
2IW9-4SP | data/2I/2IW9-4SP/2IW9-4SP_ligand.pdbqt | data/2I/2IW9-4SP/2IW9-4SP_target.pdbqt | data/2I/2IW9-4SP/2IW9-4SP_decoys.pdbqt | data/2I/2IW9-4SP/2IW9-4SP_decoy_scores.csv |
2IFB-PLM | data/2I/2IFB-PLM/2IFB-PLM_ligand.pdbqt | data/2I/2IFB-PLM/2IFB-PLM_target.pdbqt | data/2I/2IFB-PLM/2IFB-PLM_decoys.pdbqt | data/2I/2IFB-PLM/2IFB-PLM_decoy_scores.csv |
2IZH-BTN | data/2I/2IZH-BTN/2IZH-BTN_ligand.pdbqt | data/2I/2IZH-BTN/2IZH-BTN_target.pdbqt | data/2I/2IZH-BTN/2IZH-BTN_decoys.pdbqt | data/2I/2IZH-BTN/2IZH-BTN_decoy_scores.csv |
2I3V-GLU | data/2I/2I3V-GLU/2I3V-GLU_ligand.pdbqt | data/2I/2I3V-GLU/2I3V-GLU_target.pdbqt | data/2I/2I3V-GLU/2I3V-GLU_decoys.pdbqt | data/2I/2I3V-GLU/2I3V-GLU_decoy_scores.csv |
2ITE-NHE | data/2I/2ITE-NHE/2ITE-NHE_ligand.pdbqt | data/2I/2ITE-NHE/2ITE-NHE_target.pdbqt | data/2I/2ITE-NHE/2ITE-NHE_decoys.pdbqt | data/2I/2ITE-NHE/2ITE-NHE_decoy_scores.csv |
2I1R-VXR | data/2I/2I1R-VXR/2I1R-VXR_ligand.pdbqt | data/2I/2I1R-VXR/2I1R-VXR_target.pdbqt | data/2I/2I1R-VXR/2I1R-VXR_decoys.pdbqt | data/2I/2I1R-VXR/2I1R-VXR_decoy_scores.csv |
2I21-LI1 | data/2I/2I21-LI1/2I21-LI1_ligand.pdbqt | data/2I/2I21-LI1/2I21-LI1_target.pdbqt | data/2I/2I21-LI1/2I21-LI1_decoys.pdbqt | data/2I/2I21-LI1/2I21-LI1_decoy_scores.csv |
2INC-P6G | data/2I/2INC-P6G/2INC-P6G_ligand.pdbqt | data/2I/2INC-P6G/2INC-P6G_target.pdbqt | data/2I/2INC-P6G/2INC-P6G_decoys.pdbqt | data/2I/2INC-P6G/2INC-P6G_decoy_scores.csv |
2INE-PAC | data/2I/2INE-PAC/2INE-PAC_ligand.pdbqt | data/2I/2INE-PAC/2INE-PAC_target.pdbqt | data/2I/2INE-PAC/2INE-PAC_decoys.pdbqt | data/2I/2INE-PAC/2INE-PAC_decoy_scores.csv |
2IZ1-RES | data/2I/2IZ1-RES/2IZ1-RES_ligand.pdbqt | data/2I/2IZ1-RES/2IZ1-RES_target.pdbqt | data/2I/2IZ1-RES/2IZ1-RES_decoys.pdbqt | data/2I/2IZ1-RES/2IZ1-RES_decoy_scores.csv |
2IOC-D5M | data/2I/2IOC-D5M/2IOC-D5M_ligand.pdbqt | data/2I/2IOC-D5M/2IOC-D5M_target.pdbqt | data/2I/2IOC-D5M/2IOC-D5M_decoys.pdbqt | data/2I/2IOC-D5M/2IOC-D5M_decoy_scores.csv |
2IVV-PP1 | data/2I/2IVV-PP1/2IVV-PP1_ligand.pdbqt | data/2I/2IVV-PP1/2IVV-PP1_target.pdbqt | data/2I/2IVV-PP1/2IVV-PP1_decoys.pdbqt | data/2I/2IVV-PP1/2IVV-PP1_decoy_scores.csv |
2IRV-LMT | data/2I/2IRV-LMT/2IRV-LMT_ligand.pdbqt | data/2I/2IRV-LMT/2IRV-LMT_target.pdbqt | data/2I/2IRV-LMT/2IRV-LMT_decoys.pdbqt | data/2I/2IRV-LMT/2IRV-LMT_decoy_scores.csv |
2I4P-DRH | data/2I/2I4P-DRH/2I4P-DRH_ligand.pdbqt | data/2I/2I4P-DRH/2I4P-DRH_target.pdbqt | data/2I/2I4P-DRH/2I4P-DRH_decoys.pdbqt | data/2I/2I4P-DRH/2I4P-DRH_decoy_scores.csv |
2I02-P33 | data/2I/2I02-P33/2I02-P33_ligand.pdbqt | data/2I/2I02-P33/2I02-P33_target.pdbqt | data/2I/2I02-P33/2I02-P33_decoys.pdbqt | data/2I/2I02-P33/2I02-P33_decoy_scores.csv |
2IEN-017 | data/2I/2IEN-017/2IEN-017_ligand.pdbqt | data/2I/2IEN-017/2IEN-017_target.pdbqt | data/2I/2IEN-017/2IEN-017_decoys.pdbqt | data/2I/2IEN-017/2IEN-017_decoy_scores.csv |
2I29-NAD | data/2I/2I29-NAD/2I29-NAD_ligand.pdbqt | data/2I/2I29-NAD/2I29-NAD_target.pdbqt | data/2I/2I29-NAD/2I29-NAD_decoys.pdbqt | data/2I/2I29-NAD/2I29-NAD_decoy_scores.csv |
2IMF-TOM | data/2I/2IMF-TOM/2IMF-TOM_ligand.pdbqt | data/2I/2IMF-TOM/2IMF-TOM_target.pdbqt | data/2I/2IMF-TOM/2IMF-TOM_decoys.pdbqt | data/2I/2IMF-TOM/2IMF-TOM_decoy_scores.csv |
2IYG-FMN | data/2I/2IYG-FMN/2IYG-FMN_ligand.pdbqt | data/2I/2IYG-FMN/2IYG-FMN_target.pdbqt | data/2I/2IYG-FMN/2IYG-FMN_decoys.pdbqt | data/2I/2IYG-FMN/2IYG-FMN_decoy_scores.csv |
2IUZ-D1H | data/2I/2IUZ-D1H/2IUZ-D1H_ligand.pdbqt | data/2I/2IUZ-D1H/2IUZ-D1H_target.pdbqt | data/2I/2IUZ-D1H/2IUZ-D1H_decoys.pdbqt | data/2I/2IUZ-D1H/2IUZ-D1H_decoy_scores.csv |
2I7H-FMN | data/2I/2I7H-FMN/2I7H-FMN_ligand.pdbqt | data/2I/2I7H-FMN/2I7H-FMN_target.pdbqt | data/2I/2I7H-FMN/2I7H-FMN_decoys.pdbqt | data/2I/2I7H-FMN/2I7H-FMN_decoy_scores.csv |
2IXL-TRH | data/2I/2IXL-TRH/2IXL-TRH_ligand.pdbqt | data/2I/2IXL-TRH/2IXL-TRH_target.pdbqt | data/2I/2IXL-TRH/2IXL-TRH_decoys.pdbqt | data/2I/2IXL-TRH/2IXL-TRH_decoy_scores.csv |
2IXB-A2G | data/2I/2IXB-A2G/2IXB-A2G_ligand.pdbqt | data/2I/2IXB-A2G/2IXB-A2G_target.pdbqt | data/2I/2IXB-A2G/2IXB-A2G_decoys.pdbqt | data/2I/2IXB-A2G/2IXB-A2G_decoy_scores.csv |
2IPL-BGC | data/2I/2IPL-BGC/2IPL-BGC_ligand.pdbqt | data/2I/2IPL-BGC/2IPL-BGC_target.pdbqt | data/2I/2IPL-BGC/2IPL-BGC_decoys.pdbqt | data/2I/2IPL-BGC/2IPL-BGC_decoy_scores.csv |
2IZJ-BTN | data/2I/2IZJ-BTN/2IZJ-BTN_ligand.pdbqt | data/2I/2IZJ-BTN/2IZJ-BTN_target.pdbqt | data/2I/2IZJ-BTN/2IZJ-BTN_decoys.pdbqt | data/2I/2IZJ-BTN/2IZJ-BTN_decoy_scores.csv |
2IEG-PLR | data/2I/2IEG-PLR/2IEG-PLR_ligand.pdbqt | data/2I/2IEG-PLR/2IEG-PLR_target.pdbqt | data/2I/2IEG-PLR/2IEG-PLR_decoys.pdbqt | data/2I/2IEG-PLR/2IEG-PLR_decoy_scores.csv |
2I3G-BTB | data/2I/2I3G-BTB/2I3G-BTB_ligand.pdbqt | data/2I/2I3G-BTB/2I3G-BTB_target.pdbqt | data/2I/2I3G-BTB/2I3G-BTB_decoys.pdbqt | data/2I/2I3G-BTB/2I3G-BTB_decoy_scores.csv |
2IKJ-393 | data/2I/2IKJ-393/2IKJ-393_ligand.pdbqt | data/2I/2IKJ-393/2IKJ-393_target.pdbqt | data/2I/2IKJ-393/2IKJ-393_decoys.pdbqt | data/2I/2IKJ-393/2IKJ-393_decoy_scores.csv |
2IH1-1EM | data/2I/2IH1-1EM/2IH1-1EM_ligand.pdbqt | data/2I/2IH1-1EM/2IH1-1EM_target.pdbqt | data/2I/2IH1-1EM/2IH1-1EM_decoys.pdbqt | data/2I/2IH1-1EM/2IH1-1EM_decoy_scores.csv |
2IYU-ADP | data/2I/2IYU-ADP/2IYU-ADP_ligand.pdbqt | data/2I/2IYU-ADP/2IYU-ADP_target.pdbqt | data/2I/2IYU-ADP/2IYU-ADP_decoys.pdbqt | data/2I/2IYU-ADP/2IYU-ADP_decoy_scores.csv |
2IHQ-LG7 | data/2I/2IHQ-LG7/2IHQ-LG7_ligand.pdbqt | data/2I/2IHQ-LG7/2IHQ-LG7_target.pdbqt | data/2I/2IHQ-LG7/2IHQ-LG7_decoys.pdbqt | data/2I/2IHQ-LG7/2IHQ-LG7_decoy_scores.csv |
2IV7-UDP | data/2I/2IV7-UDP/2IV7-UDP_ligand.pdbqt | data/2I/2IV7-UDP/2IV7-UDP_target.pdbqt | data/2I/2IV7-UDP/2IV7-UDP_decoys.pdbqt | data/2I/2IV7-UDP/2IV7-UDP_decoy_scores.csv |
2I20-SQU | data/2I/2I20-SQU/2I20-SQU_ligand.pdbqt | data/2I/2I20-SQU/2I20-SQU_target.pdbqt | data/2I/2I20-SQU/2I20-SQU_decoys.pdbqt | data/2I/2I20-SQU/2I20-SQU_decoy_scores.csv |
2IDX-ATP | data/2I/2IDX-ATP/2IDX-ATP_ligand.pdbqt | data/2I/2IDX-ATP/2IDX-ATP_target.pdbqt | data/2I/2IDX-ATP/2IDX-ATP_decoys.pdbqt | data/2I/2IDX-ATP/2IDX-ATP_decoy_scores.csv |
2IIB-C5P | data/2I/2IIB-C5P/2IIB-C5P_ligand.pdbqt | data/2I/2IIB-C5P/2IIB-C5P_target.pdbqt | data/2I/2IIB-C5P/2IIB-C5P_decoys.pdbqt | data/2I/2IIB-C5P/2IIB-C5P_decoy_scores.csv |
2I7D-DUR | data/2I/2I7D-DUR/2I7D-DUR_ligand.pdbqt | data/2I/2I7D-DUR/2I7D-DUR_target.pdbqt | null | null |
2IDF-OPP | data/2I/2IDF-OPP/2IDF-OPP_ligand.pdbqt | data/2I/2IDF-OPP/2IDF-OPP_target.pdbqt | data/2I/2IDF-OPP/2IDF-OPP_decoys.pdbqt | data/2I/2IDF-OPP/2IDF-OPP_decoy_scores.csv |
2IH3-1EM | data/2I/2IH3-1EM/2IH3-1EM_ligand.pdbqt | data/2I/2IH3-1EM/2IH3-1EM_target.pdbqt | data/2I/2IH3-1EM/2IH3-1EM_decoys.pdbqt | data/2I/2IH3-1EM/2IH3-1EM_decoy_scores.csv |
2IEK-P6G | data/2I/2IEK-P6G/2IEK-P6G_ligand.pdbqt | data/2I/2IEK-P6G/2IEK-P6G_target.pdbqt | data/2I/2IEK-P6G/2IEK-P6G_decoys.pdbqt | data/2I/2IEK-P6G/2IEK-P6G_decoy_scores.csv |
2I8U-GDP | data/2I/2I8U-GDP/2I8U-GDP_ligand.pdbqt | data/2I/2I8U-GDP/2I8U-GDP_target.pdbqt | data/2I/2I8U-GDP/2I8U-GDP_decoys.pdbqt | data/2I/2I8U-GDP/2I8U-GDP_decoy_scores.csv |
2I78-KIQ | data/2I/2I78-KIQ/2I78-KIQ_ligand.pdbqt | data/2I/2I78-KIQ/2I78-KIQ_target.pdbqt | data/2I/2I78-KIQ/2I78-KIQ_decoys.pdbqt | data/2I/2I78-KIQ/2I78-KIQ_decoy_scores.csv |
2IBZ-SMA | data/2I/2IBZ-SMA/2IBZ-SMA_ligand.pdbqt | data/2I/2IBZ-SMA/2IBZ-SMA_target.pdbqt | data/2I/2IBZ-SMA/2IBZ-SMA_decoys.pdbqt | data/2I/2IBZ-SMA/2IBZ-SMA_decoy_scores.csv |
2IPJ-FFA | data/2I/2IPJ-FFA/2IPJ-FFA_ligand.pdbqt | data/2I/2IPJ-FFA/2IPJ-FFA_target.pdbqt | data/2I/2IPJ-FFA/2IPJ-FFA_decoys.pdbqt | data/2I/2IPJ-FFA/2IPJ-FFA_decoy_scores.csv |
2I3I-618 | data/2I/2I3I-618/2I3I-618_ligand.pdbqt | data/2I/2I3I-618/2I3I-618_target.pdbqt | data/2I/2I3I-618/2I3I-618_decoys.pdbqt | data/2I/2I3I-618/2I3I-618_decoy_scores.csv |
2IV3-UDP | data/2I/2IV3-UDP/2IV3-UDP_ligand.pdbqt | data/2I/2IV3-UDP/2IV3-UDP_target.pdbqt | data/2I/2IV3-UDP/2IV3-UDP_decoys.pdbqt | data/2I/2IV3-UDP/2IV3-UDP_decoy_scores.csv |
2IW1-U2F | data/2I/2IW1-U2F/2IW1-U2F_ligand.pdbqt | data/2I/2IW1-U2F/2IW1-U2F_target.pdbqt | data/2I/2IW1-U2F/2IW1-U2F_decoys.pdbqt | data/2I/2IW1-U2F/2IW1-U2F_decoy_scores.csv |
2I21-RET | data/2I/2I21-RET/2I21-RET_ligand.pdbqt | data/2I/2I21-RET/2I21-RET_target.pdbqt | data/2I/2I21-RET/2I21-RET_decoys.pdbqt | data/2I/2I21-RET/2I21-RET_decoy_scores.csv |
2ICA-2IC | data/2I/2ICA-2IC/2ICA-2IC_ligand.pdbqt | data/2I/2ICA-2IC/2ICA-2IC_target.pdbqt | data/2I/2ICA-2IC/2ICA-2IC_decoys.pdbqt | data/2I/2ICA-2IC/2ICA-2IC_decoy_scores.csv |
2I4V-DJR | data/2I/2I4V-DJR/2I4V-DJR_ligand.pdbqt | data/2I/2I4V-DJR/2I4V-DJR_target.pdbqt | data/2I/2I4V-DJR/2I4V-DJR_decoys.pdbqt | data/2I/2I4V-DJR/2I4V-DJR_decoy_scores.csv |
2IGT-SAM | data/2I/2IGT-SAM/2IGT-SAM_ligand.pdbqt | data/2I/2IGT-SAM/2IGT-SAM_target.pdbqt | data/2I/2IGT-SAM/2IGT-SAM_decoys.pdbqt | data/2I/2IGT-SAM/2IGT-SAM_decoy_scores.csv |
2IVD-ACJ | data/2I/2IVD-ACJ/2IVD-ACJ_ligand.pdbqt | data/2I/2IVD-ACJ/2IVD-ACJ_target.pdbqt | data/2I/2IVD-ACJ/2IVD-ACJ_decoys.pdbqt | data/2I/2IVD-ACJ/2IVD-ACJ_decoy_scores.csv |
2IVP-ATP | data/2I/2IVP-ATP/2IVP-ATP_ligand.pdbqt | data/2I/2IVP-ATP/2IVP-ATP_target.pdbqt | data/2I/2IVP-ATP/2IVP-ATP_decoys.pdbqt | data/2I/2IVP-ATP/2IVP-ATP_decoy_scores.csv |
2I3W-GLU | data/2I/2I3W-GLU/2I3W-GLU_ligand.pdbqt | data/2I/2I3W-GLU/2I3W-GLU_target.pdbqt | data/2I/2I3W-GLU/2I3W-GLU_decoys.pdbqt | data/2I/2I3W-GLU/2I3W-GLU_decoy_scores.csv |
2I17-LDT | data/2I/2I17-LDT/2I17-LDT_ligand.pdbqt | data/2I/2I17-LDT/2I17-LDT_target.pdbqt | data/2I/2I17-LDT/2I17-LDT_decoys.pdbqt | data/2I/2I17-LDT/2I17-LDT_decoy_scores.csv |
2IHV-GVA | data/2I/2IHV-GVA/2IHV-GVA_ligand.pdbqt | data/2I/2IHV-GVA/2IHV-GVA_target.pdbqt | data/2I/2IHV-GVA/2IHV-GVA_decoys.pdbqt | data/2I/2IHV-GVA/2IHV-GVA_decoy_scores.csv |
2IIP-SAH | data/2I/2IIP-SAH/2IIP-SAH_ligand.pdbqt | data/2I/2IIP-SAH/2IIP-SAH_target.pdbqt | data/2I/2IIP-SAH/2IIP-SAH_decoys.pdbqt | data/2I/2IIP-SAH/2IIP-SAH_decoy_scores.csv |
2ISK-FNR | data/2I/2ISK-FNR/2ISK-FNR_ligand.pdbqt | data/2I/2ISK-FNR/2ISK-FNR_target.pdbqt | data/2I/2ISK-FNR/2ISK-FNR_decoys.pdbqt | data/2I/2ISK-FNR/2ISK-FNR_decoy_scores.csv |
2IN6-839 | data/2I/2IN6-839/2IN6-839_ligand.pdbqt | data/2I/2IN6-839/2IN6-839_target.pdbqt | data/2I/2IN6-839/2IN6-839_decoys.pdbqt | data/2I/2IN6-839/2IN6-839_decoy_scores.csv |
2IJG-MHF | data/2I/2IJG-MHF/2IJG-MHF_ligand.pdbqt | data/2I/2IJG-MHF/2IJG-MHF_target.pdbqt | data/2I/2IJG-MHF/2IJG-MHF_decoys.pdbqt | data/2I/2IJG-MHF/2IJG-MHF_decoy_scores.csv |
2I4I-AMP | data/2I/2I4I-AMP/2I4I-AMP_ligand.pdbqt | data/2I/2I4I-AMP/2I4I-AMP_target.pdbqt | data/2I/2I4I-AMP/2I4I-AMP_decoys.pdbqt | data/2I/2I4I-AMP/2I4I-AMP_decoy_scores.csv |
2I1V-FDP | data/2I/2I1V-FDP/2I1V-FDP_ligand.pdbqt | data/2I/2I1V-FDP/2I1V-FDP_target.pdbqt | data/2I/2I1V-FDP/2I1V-FDP_decoys.pdbqt | data/2I/2I1V-FDP/2I1V-FDP_decoy_scores.csv |
2IM2-UTP | data/2I/2IM2-UTP/2IM2-UTP_ligand.pdbqt | data/2I/2IM2-UTP/2IM2-UTP_target.pdbqt | null | null |
2IZF-BTN | data/2I/2IZF-BTN/2IZF-BTN_ligand.pdbqt | data/2I/2IZF-BTN/2IZF-BTN_target.pdbqt | data/2I/2IZF-BTN/2IZF-BTN_decoys.pdbqt | data/2I/2IZF-BTN/2IZF-BTN_decoy_scores.csv |
2IRY-DGT | data/2I/2IRY-DGT/2IRY-DGT_ligand.pdbqt | data/2I/2IRY-DGT/2IRY-DGT_target.pdbqt | data/2I/2IRY-DGT/2IRY-DGT_decoys.pdbqt | data/2I/2IRY-DGT/2IRY-DGT_decoy_scores.csv |
2I1X-SQU | data/2I/2I1X-SQU/2I1X-SQU_ligand.pdbqt | data/2I/2I1X-SQU/2I1X-SQU_target.pdbqt | data/2I/2I1X-SQU/2I1X-SQU_decoys.pdbqt | data/2I/2I1X-SQU/2I1X-SQU_decoy_scores.csv |
2ISF-PAC | data/2I/2ISF-PAC/2ISF-PAC_ligand.pdbqt | data/2I/2ISF-PAC/2ISF-PAC_target.pdbqt | data/2I/2ISF-PAC/2ISF-PAC_decoys.pdbqt | data/2I/2ISF-PAC/2ISF-PAC_decoy_scores.csv |
2IWV-LDA | data/2I/2IWV-LDA/2IWV-LDA_ligand.pdbqt | data/2I/2IWV-LDA/2IWV-LDA_target.pdbqt | data/2I/2IWV-LDA/2IWV-LDA_decoys.pdbqt | data/2I/2IWV-LDA/2IWV-LDA_decoy_scores.csv |
2I2S-MNA | data/2I/2I2S-MNA/2I2S-MNA_ligand.pdbqt | data/2I/2I2S-MNA/2I2S-MNA_target.pdbqt | data/2I/2I2S-MNA/2I2S-MNA_decoys.pdbqt | data/2I/2I2S-MNA/2I2S-MNA_decoy_scores.csv |
2IMD-CXS | data/2I/2IMD-CXS/2IMD-CXS_ligand.pdbqt | data/2I/2IMD-CXS/2IMD-CXS_target.pdbqt | data/2I/2IMD-CXS/2IMD-CXS_decoys.pdbqt | data/2I/2IMD-CXS/2IMD-CXS_decoy_scores.csv |
2IG6-FMN | data/2I/2IG6-FMN/2IG6-FMN_ligand.pdbqt | data/2I/2IG6-FMN/2IG6-FMN_target.pdbqt | data/2I/2IG6-FMN/2IG6-FMN_decoys.pdbqt | data/2I/2IG6-FMN/2IG6-FMN_decoy_scores.csv |
2IXK-TDO | data/2I/2IXK-TDO/2IXK-TDO_ligand.pdbqt | data/2I/2IXK-TDO/2IXK-TDO_target.pdbqt | data/2I/2IXK-TDO/2IXK-TDO_decoys.pdbqt | data/2I/2IXK-TDO/2IXK-TDO_decoy_scores.csv |
2I0H-222 | data/2I/2I0H-222/2I0H-222_ligand.pdbqt | data/2I/2I0H-222/2I0H-222_target.pdbqt | data/2I/2I0H-222/2I0H-222_decoys.pdbqt | data/2I/2I0H-222/2I0H-222_decoy_scores.csv |
2IBZ-UQ6 | data/2I/2IBZ-UQ6/2IBZ-UQ6_ligand.pdbqt | data/2I/2IBZ-UQ6/2IBZ-UQ6_target.pdbqt | data/2I/2IBZ-UQ6/2IBZ-UQ6_decoys.pdbqt | data/2I/2IBZ-UQ6/2IBZ-UQ6_decoy_scores.csv |
2I3I-BTB | data/2I/2I3I-BTB/2I3I-BTB_ligand.pdbqt | data/2I/2I3I-BTB/2I3I-BTB_target.pdbqt | null | null |
2IZR-BRK | data/2I/2IZR-BRK/2IZR-BRK_ligand.pdbqt | data/2I/2IZR-BRK/2IZR-BRK_target.pdbqt | data/2I/2IZR-BRK/2IZR-BRK_decoys.pdbqt | data/2I/2IZR-BRK/2IZR-BRK_decoy_scores.csv |
2IXA-NAD | data/2I/2IXA-NAD/2IXA-NAD_ligand.pdbqt | data/2I/2IXA-NAD/2IXA-NAD_target.pdbqt | data/2I/2IXA-NAD/2IXA-NAD_decoys.pdbqt | data/2I/2IXA-NAD/2IXA-NAD_decoy_scores.csv |
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