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 ⌀ |
|---|---|---|---|---|
3E6Y-CW1 | data/3E/3E6Y-CW1/3E6Y-CW1_ligand.pdbqt | data/3E/3E6Y-CW1/3E6Y-CW1_target.pdbqt | data/3E/3E6Y-CW1/3E6Y-CW1_decoys.pdbqt | data/3E/3E6Y-CW1/3E6Y-CW1_decoy_scores.csv |
3EXM-GP2 | data/3E/3EXM-GP2/3EXM-GP2_ligand.pdbqt | data/3E/3EXM-GP2/3EXM-GP2_target.pdbqt | data/3E/3EXM-GP2/3EXM-GP2_decoys.pdbqt | data/3E/3EXM-GP2/3EXM-GP2_decoy_scores.csv |
3ED0-BEN | data/3E/3ED0-BEN/3ED0-BEN_ligand.pdbqt | data/3E/3ED0-BEN/3ED0-BEN_target.pdbqt | data/3E/3ED0-BEN/3ED0-BEN_decoys.pdbqt | data/3E/3ED0-BEN/3ED0-BEN_decoy_scores.csv |
3EKQ-ROC | data/3E/3EKQ-ROC/3EKQ-ROC_ligand.pdbqt | data/3E/3EKQ-ROC/3EKQ-ROC_target.pdbqt | data/3E/3EKQ-ROC/3EKQ-ROC_decoys.pdbqt | data/3E/3EKQ-ROC/3EKQ-ROC_decoy_scores.csv |
3E18-NAD | data/3E/3E18-NAD/3E18-NAD_ligand.pdbqt | data/3E/3E18-NAD/3E18-NAD_target.pdbqt | data/3E/3E18-NAD/3E18-NAD_decoys.pdbqt | data/3E/3E18-NAD/3E18-NAD_decoy_scores.csv |
3EL2-ATP | data/3E/3EL2-ATP/3EL2-ATP_ligand.pdbqt | data/3E/3EL2-ATP/3EL2-ATP_target.pdbqt | data/3E/3EL2-ATP/3EL2-ATP_decoys.pdbqt | data/3E/3EL2-ATP/3EL2-ATP_decoy_scores.csv |
3E2M-E2M | data/3E/3E2M-E2M/3E2M-E2M_ligand.pdbqt | data/3E/3E2M-E2M/3E2M-E2M_target.pdbqt | data/3E/3E2M-E2M/3E2M-E2M_decoys.pdbqt | data/3E/3E2M-E2M/3E2M-E2M_decoy_scores.csv |
3ESO-DZ2 | data/3E/3ESO-DZ2/3ESO-DZ2_ligand.pdbqt | data/3E/3ESO-DZ2/3ESO-DZ2_target.pdbqt | data/3E/3ESO-DZ2/3ESO-DZ2_decoys.pdbqt | data/3E/3ESO-DZ2/3ESO-DZ2_decoy_scores.csv |
3ETJ-ADP | data/3E/3ETJ-ADP/3ETJ-ADP_ligand.pdbqt | data/3E/3ETJ-ADP/3ETJ-ADP_target.pdbqt | data/3E/3ETJ-ADP/3ETJ-ADP_decoys.pdbqt | data/3E/3ETJ-ADP/3ETJ-ADP_decoy_scores.csv |
2FPZ-270 | data/2F/2FPZ-270/2FPZ-270_ligand.pdbqt | data/2F/2FPZ-270/2FPZ-270_target.pdbqt | data/2F/2FPZ-270/2FPZ-270_decoys.pdbqt | data/2F/2FPZ-270/2FPZ-270_decoy_scores.csv |
2FZG-CTP | data/2F/2FZG-CTP/2FZG-CTP_ligand.pdbqt | data/2F/2FZG-CTP/2FZG-CTP_target.pdbqt | data/2F/2FZG-CTP/2FZG-CTP_decoys.pdbqt | data/2F/2FZG-CTP/2FZG-CTP_decoy_scores.csv |
2FA9-GDP | data/2F/2FA9-GDP/2FA9-GDP_ligand.pdbqt | data/2F/2FA9-GDP/2FA9-GDP_target.pdbqt | data/2F/2FA9-GDP/2FA9-GDP_decoys.pdbqt | data/2F/2FA9-GDP/2FA9-GDP_decoy_scores.csv |
2F7X-4EA | data/2F/2F7X-4EA/2F7X-4EA_ligand.pdbqt | data/2F/2F7X-4EA/2F7X-4EA_target.pdbqt | data/2F/2F7X-4EA/2F7X-4EA_decoys.pdbqt | data/2F/2F7X-4EA/2F7X-4EA_decoy_scores.csv |
2FRQ-C71 | data/2F/2FRQ-C71/2FRQ-C71_ligand.pdbqt | data/2F/2FRQ-C71/2FRQ-C71_target.pdbqt | data/2F/2FRQ-C71/2FRQ-C71_decoys.pdbqt | data/2F/2FRQ-C71/2FRQ-C71_decoy_scores.csv |
2FFC-U5P | data/2F/2FFC-U5P/2FFC-U5P_ligand.pdbqt | data/2F/2FFC-U5P/2FFC-U5P_target.pdbqt | data/2F/2FFC-U5P/2FFC-U5P_decoys.pdbqt | data/2F/2FFC-U5P/2FFC-U5P_decoy_scores.csv |
2FQ9-CRJ | data/2F/2FQ9-CRJ/2FQ9-CRJ_ligand.pdbqt | data/2F/2FQ9-CRJ/2FQ9-CRJ_target.pdbqt | data/2F/2FQ9-CRJ/2FQ9-CRJ_decoys.pdbqt | data/2F/2FQ9-CRJ/2FQ9-CRJ_decoy_scores.csv |
2FB2-SAM | data/2F/2FB2-SAM/2FB2-SAM_ligand.pdbqt | data/2F/2FB2-SAM/2FB2-SAM_target.pdbqt | data/2F/2FB2-SAM/2FB2-SAM_decoys.pdbqt | data/2F/2FB2-SAM/2FB2-SAM_decoy_scores.csv |
2FTO-TMP | data/2F/2FTO-TMP/2FTO-TMP_ligand.pdbqt | data/2F/2FTO-TMP/2FTO-TMP_target.pdbqt | data/2F/2FTO-TMP/2FTO-TMP_decoys.pdbqt | data/2F/2FTO-TMP/2FTO-TMP_decoy_scores.csv |
2F3D-AMP | data/2F/2F3D-AMP/2F3D-AMP_ligand.pdbqt | data/2F/2F3D-AMP/2F3D-AMP_target.pdbqt | data/2F/2F3D-AMP/2F3D-AMP_decoys.pdbqt | data/2F/2F3D-AMP/2F3D-AMP_decoy_scores.csv |
2FBW-UMQ | data/2F/2FBW-UMQ/2FBW-UMQ_ligand.pdbqt | data/2F/2FBW-UMQ/2FBW-UMQ_target.pdbqt | data/2F/2FBW-UMQ/2FBW-UMQ_decoys.pdbqt | data/2F/2FBW-UMQ/2FBW-UMQ_decoy_scores.csv |
2FKA-CXS | data/2F/2FKA-CXS/2FKA-CXS_ligand.pdbqt | data/2F/2FKA-CXS/2FKA-CXS_target.pdbqt | null | null |
2F67-12B | data/2F/2F67-12B/2F67-12B_ligand.pdbqt | data/2F/2F67-12B/2F67-12B_target.pdbqt | data/2F/2F67-12B/2F67-12B_decoys.pdbqt | data/2F/2F67-12B/2F67-12B_decoy_scores.csv |
2F71-UN7 | data/2F/2F71-UN7/2F71-UN7_ligand.pdbqt | data/2F/2F71-UN7/2F71-UN7_target.pdbqt | data/2F/2F71-UN7/2F71-UN7_decoys.pdbqt | data/2F/2F71-UN7/2F71-UN7_decoy_scores.csv |
2FZD-TOL | data/2F/2FZD-TOL/2FZD-TOL_ligand.pdbqt | data/2F/2FZD-TOL/2FZD-TOL_target.pdbqt | data/2F/2FZD-TOL/2FZD-TOL_decoys.pdbqt | data/2F/2FZD-TOL/2FZD-TOL_decoy_scores.csv |
2FGV-QNC | data/2F/2FGV-QNC/2FGV-QNC_ligand.pdbqt | data/2F/2FGV-QNC/2FGV-QNC_target.pdbqt | data/2F/2FGV-QNC/2FGV-QNC_decoys.pdbqt | data/2F/2FGV-QNC/2FGV-QNC_decoy_scores.csv |
2FZ8-ZST | data/2F/2FZ8-ZST/2FZ8-ZST_ligand.pdbqt | data/2F/2FZ8-ZST/2FZ8-ZST_target.pdbqt | data/2F/2FZ8-ZST/2FZ8-ZST_decoys.pdbqt | data/2F/2FZ8-ZST/2FZ8-ZST_decoy_scores.csv |
2FDU-D1G | data/2F/2FDU-D1G/2FDU-D1G_ligand.pdbqt | data/2F/2FDU-D1G/2FDU-D1G_target.pdbqt | data/2F/2FDU-D1G/2FDU-D1G_decoys.pdbqt | data/2F/2FDU-D1G/2FDU-D1G_decoy_scores.csv |
2F7C-CCU | data/2F/2F7C-CCU/2F7C-CCU_ligand.pdbqt | data/2F/2F7C-CCU/2F7C-CCU_target.pdbqt | data/2F/2F7C-CCU/2F7C-CCU_decoys.pdbqt | data/2F/2F7C-CCU/2F7C-CCU_decoy_scores.csv |
2FBW-CBE | data/2F/2FBW-CBE/2FBW-CBE_ligand.pdbqt | data/2F/2FBW-CBE/2FBW-CBE_target.pdbqt | data/2F/2FBW-CBE/2FBW-CBE_decoys.pdbqt | data/2F/2FBW-CBE/2FBW-CBE_decoy_scores.csv |
2F80-017 | data/2F/2F80-017/2F80-017_ligand.pdbqt | data/2F/2F80-017/2F80-017_target.pdbqt | data/2F/2F80-017/2F80-017_decoys.pdbqt | data/2F/2F80-017/2F80-017_decoy_scores.csv |
2FSH-ANP | data/2F/2FSH-ANP/2FSH-ANP_ligand.pdbqt | data/2F/2FSH-ANP/2FSH-ANP_target.pdbqt | data/2F/2FSH-ANP/2FSH-ANP_decoys.pdbqt | data/2F/2FSH-ANP/2FSH-ANP_decoy_scores.csv |
2FES-3SP | data/2F/2FES-3SP/2FES-3SP_ligand.pdbqt | data/2F/2FES-3SP/2FES-3SP_target.pdbqt | data/2F/2FES-3SP/2FES-3SP_decoys.pdbqt | data/2F/2FES-3SP/2FES-3SP_decoy_scores.csv |
2F2E-GLC | data/2F/2F2E-GLC/2F2E-GLC_ligand.pdbqt | data/2F/2F2E-GLC/2F2E-GLC_target.pdbqt | data/2F/2F2E-GLC/2F2E-GLC_decoys.pdbqt | data/2F/2F2E-GLC/2F2E-GLC_decoy_scores.csv |
2FR6-URI | data/2F/2FR6-URI/2FR6-URI_ligand.pdbqt | data/2F/2FR6-URI/2FR6-URI_target.pdbqt | data/2F/2FR6-URI/2FR6-URI_decoys.pdbqt | data/2F/2FR6-URI/2FR6-URI_decoy_scores.csv |
2FPL-ANP | data/2F/2FPL-ANP/2FPL-ANP_ligand.pdbqt | data/2F/2FPL-ANP/2FPL-ANP_target.pdbqt | data/2F/2FPL-ANP/2FPL-ANP_decoys.pdbqt | data/2F/2FPL-ANP/2FPL-ANP_decoy_scores.csv |
2FXU-ATP | data/2F/2FXU-ATP/2FXU-ATP_ligand.pdbqt | data/2F/2FXU-ATP/2FXU-ATP_target.pdbqt | data/2F/2FXU-ATP/2FXU-ATP_decoys.pdbqt | data/2F/2FXU-ATP/2FXU-ATP_decoy_scores.csv |
2FYU-FDN | data/2F/2FYU-FDN/2FYU-FDN_ligand.pdbqt | data/2F/2FYU-FDN/2FYU-FDN_target.pdbqt | data/2F/2FYU-FDN/2FYU-FDN_decoys.pdbqt | data/2F/2FYU-FDN/2FYU-FDN_decoy_scores.csv |
2FMX-GDP | data/2F/2FMX-GDP/2FMX-GDP_ligand.pdbqt | data/2F/2FMX-GDP/2FMX-GDP_target.pdbqt | data/2F/2FMX-GDP/2FMX-GDP_decoys.pdbqt | data/2F/2FMX-GDP/2FMX-GDP_decoy_scores.csv |
2FPY-FMN | data/2F/2FPY-FMN/2FPY-FMN_ligand.pdbqt | data/2F/2FPY-FMN/2FPY-FMN_target.pdbqt | data/2F/2FPY-FMN/2FPY-FMN_decoys.pdbqt | data/2F/2FPY-FMN/2FPY-FMN_decoy_scores.csv |
2FLK-CXS | data/2F/2FLK-CXS/2FLK-CXS_ligand.pdbqt | data/2F/2FLK-CXS/2FLK-CXS_target.pdbqt | data/2F/2FLK-CXS/2FLK-CXS_decoys.pdbqt | data/2F/2FLK-CXS/2FLK-CXS_decoy_scores.csv |
2FZC-EOP | data/2F/2FZC-EOP/2FZC-EOP_ligand.pdbqt | data/2F/2FZC-EOP/2FZC-EOP_target.pdbqt | data/2F/2FZC-EOP/2FZC-EOP_decoys.pdbqt | data/2F/2FZC-EOP/2FZC-EOP_decoy_scores.csv |
2FPY-ILF | data/2F/2FPY-ILF/2FPY-ILF_ligand.pdbqt | data/2F/2FPY-ILF/2FPY-ILF_target.pdbqt | data/2F/2FPY-ILF/2FPY-ILF_decoys.pdbqt | data/2F/2FPY-ILF/2FPY-ILF_decoy_scores.csv |
2F3E-AXQ | data/2F/2F3E-AXQ/2F3E-AXQ_ligand.pdbqt | data/2F/2F3E-AXQ/2F3E-AXQ_target.pdbqt | data/2F/2F3E-AXQ/2F3E-AXQ_decoys.pdbqt | data/2F/2F3E-AXQ/2F3E-AXQ_decoy_scores.csv |
2FJN-073 | data/2F/2FJN-073/2FJN-073_ligand.pdbqt | data/2F/2FJN-073/2FJN-073_target.pdbqt | data/2F/2FJN-073/2FJN-073_decoys.pdbqt | data/2F/2FJN-073/2FJN-073_decoy_scores.csv |
2F18-GB1 | data/2F/2F18-GB1/2F18-GB1_ligand.pdbqt | data/2F/2F18-GB1/2F18-GB1_target.pdbqt | data/2F/2F18-GB1/2F18-GB1_decoys.pdbqt | data/2F/2F18-GB1/2F18-GB1_decoy_scores.csv |
2F38-15M | data/2F/2F38-15M/2F38-15M_ligand.pdbqt | data/2F/2F38-15M/2F38-15M_target.pdbqt | data/2F/2F38-15M/2F38-15M_decoys.pdbqt | data/2F/2F38-15M/2F38-15M_decoy_scores.csv |
2FSV-NAD | data/2F/2FSV-NAD/2FSV-NAD_ligand.pdbqt | data/2F/2FSV-NAD/2FSV-NAD_target.pdbqt | data/2F/2FSV-NAD/2FSV-NAD_decoys.pdbqt | data/2F/2FSV-NAD/2FSV-NAD_decoy_scores.csv |
2F9L-GDP | data/2F/2F9L-GDP/2F9L-GDP_ligand.pdbqt | data/2F/2F9L-GDP/2F9L-GDP_target.pdbqt | data/2F/2F9L-GDP/2F9L-GDP_decoys.pdbqt | data/2F/2F9L-GDP/2F9L-GDP_decoy_scores.csv |
2FXS-RDA | data/2F/2FXS-RDA/2FXS-RDA_ligand.pdbqt | data/2F/2FXS-RDA/2FXS-RDA_target.pdbqt | data/2F/2FXS-RDA/2FXS-RDA_decoys.pdbqt | data/2F/2FXS-RDA/2FXS-RDA_decoy_scores.csv |
2FGU-QNC | data/2F/2FGU-QNC/2FGU-QNC_ligand.pdbqt | data/2F/2FGU-QNC/2FGU-QNC_target.pdbqt | data/2F/2FGU-QNC/2FGU-QNC_decoys.pdbqt | data/2F/2FGU-QNC/2FGU-QNC_decoy_scores.csv |
2F3D-F6P | data/2F/2F3D-F6P/2F3D-F6P_ligand.pdbqt | data/2F/2F3D-F6P/2F3D-F6P_target.pdbqt | data/2F/2F3D-F6P/2F3D-F6P_decoys.pdbqt | data/2F/2F3D-F6P/2F3D-F6P_decoy_scores.csv |
2F34-UBA | data/2F/2F34-UBA/2F34-UBA_ligand.pdbqt | data/2F/2F34-UBA/2F34-UBA_target.pdbqt | data/2F/2F34-UBA/2F34-UBA_decoys.pdbqt | data/2F/2F34-UBA/2F34-UBA_decoy_scores.csv |
2FGV-HPH | data/2F/2FGV-HPH/2FGV-HPH_ligand.pdbqt | data/2F/2FGV-HPH/2FGV-HPH_target.pdbqt | data/2F/2FGV-HPH/2FGV-HPH_decoys.pdbqt | data/2F/2FGV-HPH/2FGV-HPH_decoy_scores.csv |
2FZK-EOZ | data/2F/2FZK-EOZ/2FZK-EOZ_ligand.pdbqt | data/2F/2FZK-EOZ/2FZK-EOZ_target.pdbqt | data/2F/2FZK-EOZ/2FZK-EOZ_decoys.pdbqt | data/2F/2FZK-EOZ/2FZK-EOZ_decoy_scores.csv |
2F7A-CCU | data/2F/2F7A-CCU/2F7A-CCU_ligand.pdbqt | data/2F/2F7A-CCU/2F7A-CCU_target.pdbqt | data/2F/2F7A-CCU/2F7A-CCU_decoys.pdbqt | data/2F/2F7A-CCU/2F7A-CCU_decoy_scores.csv |
2F48-FBP | data/2F/2F48-FBP/2F48-FBP_ligand.pdbqt | data/2F/2F48-FBP/2F48-FBP_target.pdbqt | null | null |
2FF1-IMH | data/2F/2FF1-IMH/2FF1-IMH_ligand.pdbqt | data/2F/2FF1-IMH/2FF1-IMH_target.pdbqt | data/2F/2FF1-IMH/2FF1-IMH_decoys.pdbqt | data/2F/2FF1-IMH/2FF1-IMH_decoy_scores.csv |
2FAD-PM5 | data/2F/2FAD-PM5/2FAD-PM5_ligand.pdbqt | data/2F/2FAD-PM5/2FAD-PM5_target.pdbqt | data/2F/2FAD-PM5/2FAD-PM5_decoys.pdbqt | data/2F/2FAD-PM5/2FAD-PM5_decoy_scores.csv |
2FX6-270 | data/2F/2FX6-270/2FX6-270_ligand.pdbqt | data/2F/2FX6-270/2FX6-270_target.pdbqt | data/2F/2FX6-270/2FX6-270_decoys.pdbqt | data/2F/2FX6-270/2FX6-270_decoy_scores.csv |
2F9W-PAU | data/2F/2F9W-PAU/2F9W-PAU_ligand.pdbqt | data/2F/2F9W-PAU/2F9W-PAU_target.pdbqt | data/2F/2F9W-PAU/2F9W-PAU_decoys.pdbqt | data/2F/2F9W-PAU/2F9W-PAU_decoy_scores.csv |
2FC1-ARG | data/2F/2FC1-ARG/2FC1-ARG_ligand.pdbqt | data/2F/2FC1-ARG/2FC1-ARG_target.pdbqt | data/2F/2FC1-ARG/2FC1-ARG_decoys.pdbqt | data/2F/2FC1-ARG/2FC1-ARG_decoy_scores.csv |
2FZI-DH3 | data/2F/2FZI-DH3/2FZI-DH3_ligand.pdbqt | data/2F/2FZI-DH3/2FZI-DH3_target.pdbqt | data/2F/2FZI-DH3/2FZI-DH3_decoys.pdbqt | data/2F/2FZI-DH3/2FZI-DH3_decoy_scores.csv |
2F4J-VX6 | data/2F/2F4J-VX6/2F4J-VX6_ligand.pdbqt | data/2F/2F4J-VX6/2F4J-VX6_target.pdbqt | data/2F/2F4J-VX6/2F4J-VX6_decoys.pdbqt | data/2F/2F4J-VX6/2F4J-VX6_decoy_scores.csv |
2FYD-BGC | data/2F/2FYD-BGC/2FYD-BGC_ligand.pdbqt | data/2F/2FYD-BGC/2FYD-BGC_target.pdbqt | data/2F/2FYD-BGC/2FYD-BGC_decoys.pdbqt | data/2F/2FYD-BGC/2FYD-BGC_decoy_scores.csv |
2FNU-UD1 | data/2F/2FNU-UD1/2FNU-UD1_ligand.pdbqt | data/2F/2FNU-UD1/2FNU-UD1_target.pdbqt | data/2F/2FNU-UD1/2FNU-UD1_decoys.pdbqt | data/2F/2FNU-UD1/2FNU-UD1_decoy_scores.csv |
2FJA-ADX | data/2F/2FJA-ADX/2FJA-ADX_ligand.pdbqt | data/2F/2FJA-ADX/2FJA-ADX_target.pdbqt | data/2F/2FJA-ADX/2FJA-ADX_decoys.pdbqt | data/2F/2FJA-ADX/2FJA-ADX_decoy_scores.csv |
2FE4-GDP | data/2F/2FE4-GDP/2FE4-GDP_ligand.pdbqt | data/2F/2FE4-GDP/2FE4-GDP_target.pdbqt | data/2F/2FE4-GDP/2FE4-GDP_decoys.pdbqt | data/2F/2FE4-GDP/2FE4-GDP_decoy_scores.csv |
2FDV-D2G | data/2F/2FDV-D2G/2FDV-D2G_ligand.pdbqt | data/2F/2FDV-D2G/2FDV-D2G_target.pdbqt | data/2F/2FDV-D2G/2FDV-D2G_decoys.pdbqt | data/2F/2FDV-D2G/2FDV-D2G_decoy_scores.csv |
2F95-RET | data/2F/2F95-RET/2F95-RET_ligand.pdbqt | data/2F/2F95-RET/2F95-RET_target.pdbqt | data/2F/2F95-RET/2F95-RET_decoys.pdbqt | data/2F/2F95-RET/2F95-RET_decoy_scores.csv |
2F8C-ZOL | data/2F/2F8C-ZOL/2F8C-ZOL_ligand.pdbqt | data/2F/2F8C-ZOL/2F8C-ZOL_target.pdbqt | data/2F/2F8C-ZOL/2F8C-ZOL_decoys.pdbqt | data/2F/2F8C-ZOL/2F8C-ZOL_decoy_scores.csv |
2FET-H53 | data/2F/2FET-H53/2FET-H53_ligand.pdbqt | data/2F/2FET-H53/2FET-H53_target.pdbqt | data/2F/2FET-H53/2FET-H53_decoys.pdbqt | data/2F/2FET-H53/2FET-H53_decoy_scores.csv |
2FGI-PD1 | data/2F/2FGI-PD1/2FGI-PD1_ligand.pdbqt | data/2F/2FGI-PD1/2FGI-PD1_target.pdbqt | data/2F/2FGI-PD1/2FGI-PD1_decoys.pdbqt | data/2F/2FGI-PD1/2FGI-PD1_decoy_scores.csv |
2FYT-SAH | data/2F/2FYT-SAH/2FYT-SAH_ligand.pdbqt | data/2F/2FYT-SAH/2FYT-SAH_target.pdbqt | data/2F/2FYT-SAH/2FYT-SAH_decoys.pdbqt | data/2F/2FYT-SAH/2FYT-SAH_decoy_scores.csv |
2FFU-UDP | data/2F/2FFU-UDP/2FFU-UDP_ligand.pdbqt | data/2F/2FFU-UDP/2FFU-UDP_target.pdbqt | data/2F/2FFU-UDP/2FFU-UDP_decoys.pdbqt | data/2F/2FFU-UDP/2FFU-UDP_decoy_scores.csv |
2FW4-HIS | data/2F/2FW4-HIS/2FW4-HIS_ligand.pdbqt | data/2F/2FW4-HIS/2FW4-HIS_target.pdbqt | data/2F/2FW4-HIS/2FW4-HIS_decoys.pdbqt | data/2F/2FW4-HIS/2FW4-HIS_decoy_scores.csv |
2F8I-205 | data/2F/2F8I-205/2F8I-205_ligand.pdbqt | data/2F/2F8I-205/2F8I-205_target.pdbqt | data/2F/2F8I-205/2F8I-205_decoys.pdbqt | data/2F/2F8I-205/2F8I-205_decoy_scores.csv |
2F2T-5IQ | data/2F/2F2T-5IQ/2F2T-5IQ_ligand.pdbqt | data/2F/2F2T-5IQ/2F2T-5IQ_target.pdbqt | data/2F/2F2T-5IQ/2F2T-5IQ_decoys.pdbqt | data/2F/2F2T-5IQ/2F2T-5IQ_decoy_scores.csv |
2FIR-0G7 | data/2F/2FIR-0G7/2FIR-0G7_ligand.pdbqt | data/2F/2FIR-0G7/2FIR-0G7_target.pdbqt | data/2F/2FIR-0G7/2FIR-0G7_decoys.pdbqt | data/2F/2FIR-0G7/2FIR-0G7_decoy_scores.csv |
2FEU-CAM | data/2F/2FEU-CAM/2FEU-CAM_ligand.pdbqt | data/2F/2FEU-CAM/2FEU-CAM_target.pdbqt | data/2F/2FEU-CAM/2FEU-CAM_decoys.pdbqt | data/2F/2FEU-CAM/2FEU-CAM_decoy_scores.csv |
2FVV-IHP | data/2F/2FVV-IHP/2FVV-IHP_ligand.pdbqt | data/2F/2FVV-IHP/2FVV-IHP_target.pdbqt | data/2F/2FVV-IHP/2FVV-IHP_decoys.pdbqt | data/2F/2FVV-IHP/2FVV-IHP_decoy_scores.csv |
2FS4-PZ1 | data/2F/2FS4-PZ1/2FS4-PZ1_ligand.pdbqt | data/2F/2FS4-PZ1/2FS4-PZ1_target.pdbqt | data/2F/2FS4-PZ1/2FS4-PZ1_decoys.pdbqt | data/2F/2FS4-PZ1/2FS4-PZ1_decoy_scores.csv |
2FAI-459 | data/2F/2FAI-459/2FAI-459_ligand.pdbqt | data/2F/2FAI-459/2FAI-459_target.pdbqt | data/2F/2FAI-459/2FAI-459_decoys.pdbqt | data/2F/2FAI-459/2FAI-459_decoy_scores.csv |
2FVD-LIA | data/2F/2FVD-LIA/2FVD-LIA_ligand.pdbqt | data/2F/2FVD-LIA/2FVD-LIA_target.pdbqt | data/2F/2FVD-LIA/2FVD-LIA_decoys.pdbqt | data/2F/2FVD-LIA/2FVD-LIA_decoy_scores.csv |
2FCU-DSU | data/2F/2FCU-DSU/2FCU-DSU_ligand.pdbqt | data/2F/2FCU-DSU/2FCU-DSU_target.pdbqt | data/2F/2FCU-DSU/2FCU-DSU_decoys.pdbqt | data/2F/2FCU-DSU/2FCU-DSU_decoy_scores.csv |
2FEQ-34P | data/2F/2FEQ-34P/2FEQ-34P_ligand.pdbqt | data/2F/2FEQ-34P/2FEQ-34P_target.pdbqt | data/2F/2FEQ-34P/2FEQ-34P_decoys.pdbqt | data/2F/2FEQ-34P/2FEQ-34P_decoy_scores.csv |
2FBR-44C | data/2F/2FBR-44C/2FBR-44C_ligand.pdbqt | data/2F/2FBR-44C/2FBR-44C_target.pdbqt | data/2F/2FBR-44C/2FBR-44C_decoys.pdbqt | data/2F/2FBR-44C/2FBR-44C_decoy_scores.csv |
2FV7-ADP | data/2F/2FV7-ADP/2FV7-ADP_ligand.pdbqt | data/2F/2FV7-ADP/2FV7-ADP_target.pdbqt | data/2F/2FV7-ADP/2FV7-ADP_decoys.pdbqt | data/2F/2FV7-ADP/2FV7-ADP_decoy_scores.csv |
2FN4-GDP | data/2F/2FN4-GDP/2FN4-GDP_ligand.pdbqt | data/2F/2FN4-GDP/2FN4-GDP_target.pdbqt | data/2F/2FN4-GDP/2FN4-GDP_decoys.pdbqt | data/2F/2FN4-GDP/2FN4-GDP_decoy_scores.csv |
2FFB-ADP | data/2F/2FFB-ADP/2FFB-ADP_ligand.pdbqt | data/2F/2FFB-ADP/2FFB-ADP_target.pdbqt | data/2F/2FFB-ADP/2FFB-ADP_decoys.pdbqt | data/2F/2FFB-ADP/2FFB-ADP_decoy_scores.csv |
2F9G-ADP | data/2F/2F9G-ADP/2F9G-ADP_ligand.pdbqt | data/2F/2F9G-ADP/2F9G-ADP_target.pdbqt | data/2F/2F9G-ADP/2F9G-ADP_decoys.pdbqt | data/2F/2F9G-ADP/2F9G-ADP_decoy_scores.csv |
2FAV-APR | data/2F/2FAV-APR/2FAV-APR_ligand.pdbqt | data/2F/2FAV-APR/2FAV-APR_target.pdbqt | data/2F/2FAV-APR/2FAV-APR_decoys.pdbqt | data/2F/2FAV-APR/2FAV-APR_decoy_scores.csv |
2F27-DAN | data/2F/2F27-DAN/2F27-DAN_ligand.pdbqt | data/2F/2F27-DAN/2F27-DAN_target.pdbqt | data/2F/2F27-DAN/2F27-DAN_decoys.pdbqt | data/2F/2F27-DAN/2F27-DAN_decoy_scores.csv |
2FHN-BNI | data/2F/2FHN-BNI/2FHN-BNI_ligand.pdbqt | data/2F/2FHN-BNI/2FHN-BNI_target.pdbqt | data/2F/2FHN-BNI/2FHN-BNI_decoys.pdbqt | data/2F/2FHN-BNI/2FHN-BNI_decoy_scores.csv |
2F9K-ZOL | data/2F/2F9K-ZOL/2F9K-ZOL_ligand.pdbqt | data/2F/2F9K-ZOL/2F9K-ZOL_target.pdbqt | data/2F/2F9K-ZOL/2F9K-ZOL_decoys.pdbqt | data/2F/2F9K-ZOL/2F9K-ZOL_decoy_scores.csv |
2F70-UN6 | data/2F/2F70-UN6/2F70-UN6_ligand.pdbqt | data/2F/2F70-UN6/2F70-UN6_target.pdbqt | data/2F/2F70-UN6/2F70-UN6_decoys.pdbqt | data/2F/2F70-UN6/2F70-UN6_decoy_scores.csv |
2FMN-4HF | data/2F/2FMN-4HF/2FMN-4HF_ligand.pdbqt | data/2F/2FMN-4HF/2FMN-4HF_target.pdbqt | data/2F/2FMN-4HF/2FMN-4HF_decoys.pdbqt | data/2F/2FMN-4HF/2FMN-4HF_decoy_scores.csv |
2FN7-NAD | data/2F/2FN7-NAD/2FN7-NAD_ligand.pdbqt | data/2F/2FN7-NAD/2FN7-NAD_target.pdbqt | data/2F/2FN7-NAD/2FN7-NAD_decoys.pdbqt | data/2F/2FN7-NAD/2FN7-NAD_decoy_scores.csv |
2FZH-DH1 | data/2F/2FZH-DH1/2FZH-DH1_ligand.pdbqt | data/2F/2FZH-DH1/2FZH-DH1_target.pdbqt | data/2F/2FZH-DH1/2FZH-DH1_decoys.pdbqt | data/2F/2FZH-DH1/2FZH-DH1_decoy_scores.csv |
2F2G-HMH | data/2F/2F2G-HMH/2F2G-HMH_ligand.pdbqt | data/2F/2F2G-HMH/2F2G-HMH_target.pdbqt | data/2F/2F2G-HMH/2F2G-HMH_decoys.pdbqt | data/2F/2F2G-HMH/2F2G-HMH_decoy_scores.csv |
2FDP-FRP | data/2F/2FDP-FRP/2FDP-FRP_ligand.pdbqt | data/2F/2FDP-FRP/2FDP-FRP_target.pdbqt | data/2F/2FDP-FRP/2FDP-FRP_decoys.pdbqt | data/2F/2FDP-FRP/2FDP-FRP_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.