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 ⌀ |
|---|---|---|---|---|
1UP2-IFM | data/1U/1UP2-IFM/1UP2-IFM_ligand.pdbqt | data/1U/1UP2-IFM/1UP2-IFM_target.pdbqt | data/1U/1UP2-IFM/1UP2-IFM_decoys.pdbqt | data/1U/1UP2-IFM/1UP2-IFM_decoy_scores.csv |
1UOU-CMU | data/1U/1UOU-CMU/1UOU-CMU_ligand.pdbqt | data/1U/1UOU-CMU/1UOU-CMU_target.pdbqt | data/1U/1UOU-CMU/1UOU-CMU_decoys.pdbqt | data/1U/1UOU-CMU/1UOU-CMU_decoy_scores.csv |
1U9Q-186 | data/1U/1U9Q-186/1U9Q-186_ligand.pdbqt | data/1U/1U9Q-186/1U9Q-186_target.pdbqt | data/1U/1U9Q-186/1U9Q-186_decoys.pdbqt | data/1U/1U9Q-186/1U9Q-186_decoy_scores.csv |
1UWA-CAP | data/1U/1UWA-CAP/1UWA-CAP_ligand.pdbqt | data/1U/1UWA-CAP/1UWA-CAP_target.pdbqt | data/1U/1UWA-CAP/1UWA-CAP_decoys.pdbqt | data/1U/1UWA-CAP/1UWA-CAP_decoy_scores.csv |
1U3W-FXY | data/1U/1U3W-FXY/1U3W-FXY_ligand.pdbqt | data/1U/1U3W-FXY/1U3W-FXY_target.pdbqt | data/1U/1U3W-FXY/1U3W-FXY_decoys.pdbqt | data/1U/1U3W-FXY/1U3W-FXY_decoy_scores.csv |
1UC9-ADP | data/1U/1UC9-ADP/1UC9-ADP_ligand.pdbqt | data/1U/1UC9-ADP/1UC9-ADP_target.pdbqt | data/1U/1UC9-ADP/1UC9-ADP_decoys.pdbqt | data/1U/1UC9-ADP/1UC9-ADP_decoy_scores.csv |
1U6R-ADP | data/1U/1U6R-ADP/1U6R-ADP_ligand.pdbqt | data/1U/1U6R-ADP/1U6R-ADP_target.pdbqt | data/1U/1U6R-ADP/1U6R-ADP_decoys.pdbqt | data/1U/1U6R-ADP/1U6R-ADP_decoy_scores.csv |
1UYQ-NFG | data/1U/1UYQ-NFG/1UYQ-NFG_ligand.pdbqt | data/1U/1UYQ-NFG/1UYQ-NFG_target.pdbqt | data/1U/1UYQ-NFG/1UYQ-NFG_decoys.pdbqt | data/1U/1UYQ-NFG/1UYQ-NFG_decoy_scores.csv |
1U7Z-PMT | data/1U/1U7Z-PMT/1U7Z-PMT_ligand.pdbqt | data/1U/1U7Z-PMT/1U7Z-PMT_target.pdbqt | data/1U/1U7Z-PMT/1U7Z-PMT_decoys.pdbqt | data/1U/1U7Z-PMT/1U7Z-PMT_decoy_scores.csv |
1UWU-GOX | data/1U/1UWU-GOX/1UWU-GOX_ligand.pdbqt | data/1U/1UWU-GOX/1UWU-GOX_target.pdbqt | data/1U/1UWU-GOX/1UWU-GOX_decoys.pdbqt | data/1U/1UWU-GOX/1UWU-GOX_decoy_scores.csv |
1UOG-P1C | data/1U/1UOG-P1C/1UOG-P1C_ligand.pdbqt | data/1U/1UOG-P1C/1UOG-P1C_target.pdbqt | data/1U/1UOG-P1C/1UOG-P1C_decoys.pdbqt | data/1U/1UOG-P1C/1UOG-P1C_decoy_scores.csv |
1UZU-INR | data/1U/1UZU-INR/1UZU-INR_ligand.pdbqt | data/1U/1UZU-INR/1UZU-INR_target.pdbqt | data/1U/1UZU-INR/1UZU-INR_decoys.pdbqt | data/1U/1UZU-INR/1UZU-INR_decoy_scores.csv |
1UYU-CAM | data/1U/1UYU-CAM/1UYU-CAM_ligand.pdbqt | data/1U/1UYU-CAM/1UYU-CAM_target.pdbqt | null | null |
1UYG-PU2 | data/1U/1UYG-PU2/1UYG-PU2_ligand.pdbqt | data/1U/1UYG-PU2/1UYG-PU2_target.pdbqt | data/1U/1UYG-PU2/1UYG-PU2_decoys.pdbqt | data/1U/1UYG-PU2/1UYG-PU2_decoy_scores.csv |
1UV6-CCE | data/1U/1UV6-CCE/1UV6-CCE_ligand.pdbqt | data/1U/1UV6-CCE/1UV6-CCE_target.pdbqt | data/1U/1UV6-CCE/1UV6-CCE_decoys.pdbqt | data/1U/1UV6-CCE/1UV6-CCE_decoy_scores.csv |
1UUY-MTE | data/1U/1UUY-MTE/1UUY-MTE_ligand.pdbqt | data/1U/1UUY-MTE/1UUY-MTE_target.pdbqt | data/1U/1UUY-MTE/1UUY-MTE_decoys.pdbqt | data/1U/1UUY-MTE/1UUY-MTE_decoy_scores.csv |
1U2Y-GOX | data/1U/1U2Y-GOX/1U2Y-GOX_ligand.pdbqt | data/1U/1U2Y-GOX/1U2Y-GOX_target.pdbqt | data/1U/1U2Y-GOX/1U2Y-GOX_decoys.pdbqt | data/1U/1U2Y-GOX/1U2Y-GOX_decoy_scores.csv |
1UM4-SH4 | data/1U/1UM4-SH4/1UM4-SH4_ligand.pdbqt | data/1U/1UM4-SH4/1UM4-SH4_target.pdbqt | data/1U/1UM4-SH4/1UM4-SH4_decoys.pdbqt | data/1U/1UM4-SH4/1UM4-SH4_decoy_scores.csv |
1UYH-PU0 | data/1U/1UYH-PU0/1UYH-PU0_ligand.pdbqt | data/1U/1UYH-PU0/1UYH-PU0_target.pdbqt | data/1U/1UYH-PU0/1UYH-PU0_decoys.pdbqt | data/1U/1UYH-PU0/1UYH-PU0_decoy_scores.csv |
1UH5-TCL | data/1U/1UH5-TCL/1UH5-TCL_ligand.pdbqt | data/1U/1UH5-TCL/1UH5-TCL_target.pdbqt | data/1U/1UH5-TCL/1UH5-TCL_decoys.pdbqt | data/1U/1UH5-TCL/1UH5-TCL_decoy_scores.csv |
1UNG-ALH | data/1U/1UNG-ALH/1UNG-ALH_ligand.pdbqt | data/1U/1UNG-ALH/1UNG-ALH_target.pdbqt | data/1U/1UNG-ALH/1UNG-ALH_decoys.pdbqt | data/1U/1UNG-ALH/1UNG-ALH_decoy_scores.csv |
1UDB-UFG | data/1U/1UDB-UFG/1UDB-UFG_ligand.pdbqt | data/1U/1UDB-UFG/1UDB-UFG_target.pdbqt | data/1U/1UDB-UFG/1UDB-UFG_decoys.pdbqt | data/1U/1UDB-UFG/1UDB-UFG_decoy_scores.csv |
1UDA-NAD | data/1U/1UDA-NAD/1UDA-NAD_ligand.pdbqt | data/1U/1UDA-NAD/1UDA-NAD_target.pdbqt | data/1U/1UDA-NAD/1UDA-NAD_decoys.pdbqt | data/1U/1UDA-NAD/1UDA-NAD_decoy_scores.csv |
1UYI-PUZ | data/1U/1UYI-PUZ/1UYI-PUZ_ligand.pdbqt | data/1U/1UYI-PUZ/1UYI-PUZ_target.pdbqt | data/1U/1UYI-PUZ/1UYI-PUZ_decoys.pdbqt | data/1U/1UYI-PUZ/1UYI-PUZ_decoy_scores.csv |
1U3U-BNF | data/1U/1U3U-BNF/1U3U-BNF_ligand.pdbqt | data/1U/1U3U-BNF/1U3U-BNF_target.pdbqt | data/1U/1U3U-BNF/1U3U-BNF_decoys.pdbqt | data/1U/1U3U-BNF/1U3U-BNF_decoy_scores.csv |
1UHE-NSN | data/1U/1UHE-NSN/1UHE-NSN_ligand.pdbqt | data/1U/1UHE-NSN/1UHE-NSN_target.pdbqt | data/1U/1UHE-NSN/1UHE-NSN_decoys.pdbqt | data/1U/1UHE-NSN/1UHE-NSN_decoy_scores.csv |
1UPU-U5P | data/1U/1UPU-U5P/1UPU-U5P_ligand.pdbqt | data/1U/1UPU-U5P/1UPU-U5P_target.pdbqt | data/1U/1UPU-U5P/1UPU-U5P_decoys.pdbqt | data/1U/1UPU-U5P/1UPU-U5P_decoy_scores.csv |
1UGU-HC4 | data/1U/1UGU-HC4/1UGU-HC4_ligand.pdbqt | data/1U/1UGU-HC4/1UGU-HC4_target.pdbqt | data/1U/1UGU-HC4/1UGU-HC4_decoys.pdbqt | data/1U/1UGU-HC4/1UGU-HC4_decoy_scores.csv |
1UY9-PU6 | data/1U/1UY9-PU6/1UY9-PU6_ligand.pdbqt | data/1U/1UY9-PU6/1UY9-PU6_target.pdbqt | data/1U/1UY9-PU6/1UY9-PU6_decoys.pdbqt | data/1U/1UY9-PU6/1UY9-PU6_decoy_scores.csv |
1UU3-LY4 | data/1U/1UU3-LY4/1UU3-LY4_ligand.pdbqt | data/1U/1UU3-LY4/1UU3-LY4_target.pdbqt | data/1U/1UU3-LY4/1UU3-LY4_decoys.pdbqt | data/1U/1UU3-LY4/1UU3-LY4_decoy_scores.csv |
1UXT-NAD | data/1U/1UXT-NAD/1UXT-NAD_ligand.pdbqt | data/1U/1UXT-NAD/1UXT-NAD_target.pdbqt | data/1U/1UXT-NAD/1UXT-NAD_decoys.pdbqt | data/1U/1UXT-NAD/1UXT-NAD_decoy_scores.csv |
1UF8-ING | data/1U/1UF8-ING/1UF8-ING_ligand.pdbqt | data/1U/1UF8-ING/1UF8-ING_target.pdbqt | data/1U/1UF8-ING/1UF8-ING_decoys.pdbqt | data/1U/1UF8-ING/1UF8-ING_decoy_scores.csv |
1US4-GLU | data/1U/1US4-GLU/1US4-GLU_ligand.pdbqt | data/1U/1US4-GLU/1US4-GLU_target.pdbqt | data/1U/1US4-GLU/1US4-GLU_decoys.pdbqt | data/1U/1US4-GLU/1US4-GLU_decoy_scores.csv |
1UKG-MMA | data/1U/1UKG-MMA/1UKG-MMA_ligand.pdbqt | data/1U/1UKG-MMA/1UKG-MMA_target.pdbqt | data/1U/1UKG-MMA/1UKG-MMA_decoys.pdbqt | data/1U/1UKG-MMA/1UKG-MMA_decoy_scores.csv |
1U1J-C2F | data/1U/1U1J-C2F/1U1J-C2F_ligand.pdbqt | data/1U/1U1J-C2F/1U1J-C2F_target.pdbqt | data/1U/1U1J-C2F/1U1J-C2F_decoys.pdbqt | data/1U/1U1J-C2F/1U1J-C2F_decoy_scores.csv |
1UXV-AMP | data/1U/1UXV-AMP/1UXV-AMP_ligand.pdbqt | data/1U/1UXV-AMP/1UXV-AMP_target.pdbqt | data/1U/1UXV-AMP/1UXV-AMP_decoys.pdbqt | data/1U/1UXV-AMP/1UXV-AMP_decoy_scores.csv |
1UN8-MYY | data/1U/1UN8-MYY/1UN8-MYY_ligand.pdbqt | data/1U/1UN8-MYY/1UN8-MYY_target.pdbqt | data/1U/1UN8-MYY/1UN8-MYY_decoys.pdbqt | data/1U/1UN8-MYY/1UN8-MYY_decoy_scores.csv |
1UYE-PU9 | data/1U/1UYE-PU9/1UYE-PU9_ligand.pdbqt | data/1U/1UYE-PU9/1UYE-PU9_target.pdbqt | data/1U/1UYE-PU9/1UYE-PU9_decoys.pdbqt | data/1U/1UYE-PU9/1UYE-PU9_decoy_scores.csv |
1U3L-CDP | data/1U/1U3L-CDP/1U3L-CDP_ligand.pdbqt | data/1U/1U3L-CDP/1U3L-CDP_target.pdbqt | data/1U/1U3L-CDP/1U3L-CDP_decoys.pdbqt | data/1U/1U3L-CDP/1U3L-CDP_decoy_scores.csv |
1UKV-GDP | data/1U/1UKV-GDP/1UKV-GDP_ligand.pdbqt | data/1U/1UKV-GDP/1UKV-GDP_target.pdbqt | data/1U/1UKV-GDP/1UKV-GDP_decoys.pdbqt | data/1U/1UKV-GDP/1UKV-GDP_decoy_scores.csv |
1UVT-I48 | data/1U/1UVT-I48/1UVT-I48_ligand.pdbqt | data/1U/1UVT-I48/1UVT-I48_target.pdbqt | data/1U/1UVT-I48/1UVT-I48_decoys.pdbqt | data/1U/1UVT-I48/1UVT-I48_decoy_scores.csv |
1U8A-ADP | data/1U/1U8A-ADP/1U8A-ADP_ligand.pdbqt | data/1U/1U8A-ADP/1U8A-ADP_target.pdbqt | data/1U/1U8A-ADP/1U8A-ADP_decoys.pdbqt | data/1U/1U8A-ADP/1U8A-ADP_decoy_scores.csv |
1UXR-F6P | data/1U/1UXR-F6P/1UXR-F6P_ligand.pdbqt | data/1U/1UXR-F6P/1UXR-F6P_target.pdbqt | data/1U/1UXR-F6P/1UXR-F6P_decoys.pdbqt | data/1U/1UXR-F6P/1UXR-F6P_decoy_scores.csv |
1U8X-NAD | data/1U/1U8X-NAD/1U8X-NAD_ligand.pdbqt | data/1U/1U8X-NAD/1U8X-NAD_target.pdbqt | data/1U/1U8X-NAD/1U8X-NAD_decoys.pdbqt | data/1U/1U8X-NAD/1U8X-NAD_decoy_scores.csv |
1U8U-OCA | data/1U/1U8U-OCA/1U8U-OCA_ligand.pdbqt | data/1U/1U8U-OCA/1U8U-OCA_target.pdbqt | data/1U/1U8U-OCA/1U8U-OCA_decoys.pdbqt | data/1U/1U8U-OCA/1U8U-OCA_decoy_scores.csv |
1U9V-IHE | data/1U/1U9V-IHE/1U9V-IHE_ligand.pdbqt | data/1U/1U9V-IHE/1U9V-IHE_target.pdbqt | data/1U/1U9V-IHE/1U9V-IHE_decoys.pdbqt | data/1U/1U9V-IHE/1U9V-IHE_decoy_scores.csv |
1UWS-G2F | data/1U/1UWS-G2F/1UWS-G2F_ligand.pdbqt | data/1U/1UWS-G2F/1UWS-G2F_target.pdbqt | data/1U/1UWS-G2F/1UWS-G2F_decoys.pdbqt | data/1U/1UWS-G2F/1UWS-G2F_decoy_scores.csv |
1UOF-PNN | data/1U/1UOF-PNN/1UOF-PNN_ligand.pdbqt | data/1U/1UOF-PNN/1UOF-PNN_target.pdbqt | data/1U/1UOF-PNN/1UOF-PNN_decoys.pdbqt | data/1U/1UOF-PNN/1UOF-PNN_decoy_scores.csv |
1UAM-SAH | data/1U/1UAM-SAH/1UAM-SAH_ligand.pdbqt | data/1U/1UAM-SAH/1UAM-SAH_target.pdbqt | data/1U/1UAM-SAH/1UAM-SAH_decoys.pdbqt | data/1U/1UAM-SAH/1UAM-SAH_decoy_scores.csv |
1UXU-G3H | data/1U/1UXU-G3H/1UXU-G3H_ligand.pdbqt | data/1U/1UXU-G3H/1UXU-G3H_target.pdbqt | data/1U/1UXU-G3H/1UXU-G3H_decoys.pdbqt | data/1U/1UXU-G3H/1UXU-G3H_decoy_scores.csv |
1UTP-PBN | data/1U/1UTP-PBN/1UTP-PBN_ligand.pdbqt | data/1U/1UTP-PBN/1UTP-PBN_target.pdbqt | data/1U/1UTP-PBN/1UTP-PBN_decoys.pdbqt | data/1U/1UTP-PBN/1UTP-PBN_decoy_scores.csv |
1U3T-CCB | data/1U/1U3T-CCB/1U3T-CCB_ligand.pdbqt | data/1U/1U3T-CCB/1U3T-CCB_target.pdbqt | data/1U/1U3T-CCB/1U3T-CCB_decoys.pdbqt | data/1U/1U3T-CCB/1U3T-CCB_decoy_scores.csv |
1UJ2-ADP | data/1U/1UJ2-ADP/1UJ2-ADP_ligand.pdbqt | data/1U/1UJ2-ADP/1UJ2-ADP_target.pdbqt | data/1U/1UJ2-ADP/1UJ2-ADP_decoys.pdbqt | data/1U/1UJ2-ADP/1UJ2-ADP_decoy_scores.csv |
1UHI-CZI | data/1U/1UHI-CZI/1UHI-CZI_ligand.pdbqt | data/1U/1UHI-CZI/1UHI-CZI_target.pdbqt | data/1U/1UHI-CZI/1UHI-CZI_decoys.pdbqt | data/1U/1UHI-CZI/1UHI-CZI_decoy_scores.csv |
1UYK-PUX | data/1U/1UYK-PUX/1UYK-PUX_ligand.pdbqt | data/1U/1UYK-PUX/1UYK-PUX_target.pdbqt | data/1U/1UYK-PUX/1UYK-PUX_decoys.pdbqt | data/1U/1UYK-PUX/1UYK-PUX_decoy_scores.csv |
1U29-I3P | data/1U/1U29-I3P/1U29-I3P_ligand.pdbqt | data/1U/1U29-I3P/1U29-I3P_target.pdbqt | data/1U/1U29-I3P/1U29-I3P_decoys.pdbqt | data/1U/1U29-I3P/1U29-I3P_decoy_scores.csv |
1URL-SIA | data/1U/1URL-SIA/1URL-SIA_ligand.pdbqt | data/1U/1URL-SIA/1URL-SIA_target.pdbqt | data/1U/1URL-SIA/1URL-SIA_decoys.pdbqt | data/1U/1URL-SIA/1URL-SIA_decoy_scores.csv |
1UYM-PU3 | data/1U/1UYM-PU3/1UYM-PU3_ligand.pdbqt | data/1U/1UYM-PU3/1UYM-PU3_target.pdbqt | data/1U/1UYM-PU3/1UYM-PU3_decoys.pdbqt | data/1U/1UYM-PU3/1UYM-PU3_decoy_scores.csv |
1UKV-GER | data/1U/1UKV-GER/1UKV-GER_ligand.pdbqt | data/1U/1UKV-GER/1UKV-GER_target.pdbqt | data/1U/1UKV-GER/1UKV-GER_decoys.pdbqt | data/1U/1UKV-GER/1UKV-GER_decoy_scores.csv |
1UOD-G3H | data/1U/1UOD-G3H/1UOD-G3H_ligand.pdbqt | data/1U/1UOD-G3H/1UOD-G3H_target.pdbqt | data/1U/1UOD-G3H/1UOD-G3H_decoys.pdbqt | data/1U/1UOD-G3H/1UOD-G3H_decoy_scores.csv |
1U2O-NEC | data/1U/1U2O-NEC/1U2O-NEC_ligand.pdbqt | data/1U/1U2O-NEC/1U2O-NEC_target.pdbqt | data/1U/1U2O-NEC/1U2O-NEC_decoys.pdbqt | data/1U/1U2O-NEC/1U2O-NEC_decoy_scores.csv |
1UZ9-UZ9 | data/1U/1UZ9-UZ9/1UZ9-UZ9_ligand.pdbqt | data/1U/1UZ9-UZ9/1UZ9-UZ9_target.pdbqt | data/1U/1UZ9-UZ9/1UZ9-UZ9_decoys.pdbqt | data/1U/1UZ9-UZ9/1UZ9-UZ9_decoy_scores.csv |
1UA4-GLC | data/1U/1UA4-GLC/1UA4-GLC_ligand.pdbqt | data/1U/1UA4-GLC/1UA4-GLC_target.pdbqt | data/1U/1UA4-GLC/1UA4-GLC_decoys.pdbqt | data/1U/1UA4-GLC/1UA4-GLC_decoy_scores.csv |
1UU9-BI3 | data/1U/1UU9-BI3/1UU9-BI3_ligand.pdbqt | data/1U/1UU9-BI3/1UU9-BI3_target.pdbqt | data/1U/1UU9-BI3/1UU9-BI3_decoys.pdbqt | data/1U/1UU9-BI3/1UU9-BI3_decoy_scores.csv |
1UUX-MTE | data/1U/1UUX-MTE/1UUX-MTE_ligand.pdbqt | data/1U/1UUX-MTE/1UUX-MTE_target.pdbqt | data/1U/1UUX-MTE/1UUX-MTE_decoys.pdbqt | data/1U/1UUX-MTE/1UUX-MTE_decoy_scores.csv |
1UDA-UFG | data/1U/1UDA-UFG/1UDA-UFG_ligand.pdbqt | data/1U/1UDA-UFG/1UDA-UFG_target.pdbqt | data/1U/1UDA-UFG/1UDA-UFG_decoys.pdbqt | data/1U/1UDA-UFG/1UDA-UFG_decoy_scores.csv |
1UCD-U5P | data/1U/1UCD-U5P/1UCD-U5P_ligand.pdbqt | data/1U/1UCD-U5P/1UCD-U5P_target.pdbqt | data/1U/1UCD-U5P/1UCD-U5P_decoys.pdbqt | data/1U/1UCD-U5P/1UCD-U5P_decoy_scores.csv |
1U8Y-GNP | data/1U/1U8Y-GNP/1U8Y-GNP_ligand.pdbqt | data/1U/1U8Y-GNP/1U8Y-GNP_target.pdbqt | data/1U/1U8Y-GNP/1U8Y-GNP_decoys.pdbqt | data/1U/1U8Y-GNP/1U8Y-GNP_decoy_scores.csv |
1U4S-BIH | data/1U/1U4S-BIH/1U4S-BIH_ligand.pdbqt | data/1U/1U4S-BIH/1U4S-BIH_target.pdbqt | data/1U/1U4S-BIH/1U4S-BIH_decoys.pdbqt | data/1U/1U4S-BIH/1U4S-BIH_decoy_scores.csv |
1US5-GLU | data/1U/1US5-GLU/1US5-GLU_ligand.pdbqt | data/1U/1US5-GLU/1US5-GLU_target.pdbqt | data/1U/1US5-GLU/1US5-GLU_decoys.pdbqt | data/1U/1US5-GLU/1US5-GLU_decoy_scores.csv |
1UMA-IN2 | data/1U/1UMA-IN2/1UMA-IN2_ligand.pdbqt | data/1U/1UMA-IN2/1UMA-IN2_target.pdbqt | data/1U/1UMA-IN2/1UMA-IN2_decoys.pdbqt | data/1U/1UMA-IN2/1UMA-IN2_decoy_scores.csv |
1U8Z-GDP | data/1U/1U8Z-GDP/1U8Z-GDP_ligand.pdbqt | data/1U/1U8Z-GDP/1U8Z-GDP_target.pdbqt | data/1U/1U8Z-GDP/1U8Z-GDP_decoys.pdbqt | data/1U/1U8Z-GDP/1U8Z-GDP_decoy_scores.csv |
1U0J-ADP | data/1U/1U0J-ADP/1U0J-ADP_ligand.pdbqt | data/1U/1U0J-ADP/1U0J-ADP_target.pdbqt | data/1U/1U0J-ADP/1U0J-ADP_decoys.pdbqt | data/1U/1U0J-ADP/1U0J-ADP_decoy_scores.csv |
1U30-GOX | data/1U/1U30-GOX/1U30-GOX_ligand.pdbqt | data/1U/1U30-GOX/1U30-GOX_target.pdbqt | data/1U/1U30-GOX/1U30-GOX_decoys.pdbqt | data/1U/1U30-GOX/1U30-GOX_decoy_scores.csv |
1UWK-NAD | data/1U/1UWK-NAD/1UWK-NAD_ligand.pdbqt | data/1U/1UWK-NAD/1UWK-NAD_target.pdbqt | data/1U/1UWK-NAD/1UWK-NAD_decoys.pdbqt | data/1U/1UWK-NAD/1UWK-NAD_decoy_scores.csv |
1U3D-NDS | data/1U/1U3D-NDS/1U3D-NDS_ligand.pdbqt | data/1U/1U3D-NDS/1U3D-NDS_target.pdbqt | data/1U/1U3D-NDS/1U3D-NDS_decoys.pdbqt | data/1U/1U3D-NDS/1U3D-NDS_decoy_scores.csv |
1UM0-FMN | data/1U/1UM0-FMN/1UM0-FMN_ligand.pdbqt | data/1U/1UM0-FMN/1UM0-FMN_target.pdbqt | data/1U/1UM0-FMN/1UM0-FMN_decoys.pdbqt | data/1U/1UM0-FMN/1UM0-FMN_decoy_scores.csv |
1UW9-CAP | data/1U/1UW9-CAP/1UW9-CAP_ligand.pdbqt | data/1U/1UW9-CAP/1UW9-CAP_target.pdbqt | data/1U/1UW9-CAP/1UW9-CAP_decoys.pdbqt | data/1U/1UW9-CAP/1UW9-CAP_decoy_scores.csv |
1U8A-SKM | data/1U/1U8A-SKM/1U8A-SKM_ligand.pdbqt | data/1U/1U8A-SKM/1U8A-SKM_target.pdbqt | data/1U/1U8A-SKM/1U8A-SKM_decoys.pdbqt | data/1U/1U8A-SKM/1U8A-SKM_decoy_scores.csv |
1U6Q-745 | data/1U/1U6Q-745/1U6Q-745_ligand.pdbqt | data/1U/1U6Q-745/1U6Q-745_target.pdbqt | data/1U/1U6Q-745/1U6Q-745_decoys.pdbqt | data/1U/1U6Q-745/1U6Q-745_decoy_scores.csv |
1UYF-PU1 | data/1U/1UYF-PU1/1UYF-PU1_ligand.pdbqt | data/1U/1UYF-PU1/1UYF-PU1_target.pdbqt | data/1U/1UYF-PU1/1UYF-PU1_decoys.pdbqt | data/1U/1UYF-PU1/1UYF-PU1_decoy_scores.csv |
1UPR-4IP | data/1U/1UPR-4IP/1UPR-4IP_ligand.pdbqt | data/1U/1UPR-4IP/1UPR-4IP_target.pdbqt | data/1U/1UPR-4IP/1UPR-4IP_decoys.pdbqt | data/1U/1UPR-4IP/1UPR-4IP_decoy_scores.csv |
1UP2-1PG | data/1U/1UP2-1PG/1UP2-1PG_ligand.pdbqt | data/1U/1UP2-1PG/1UP2-1PG_target.pdbqt | data/1U/1UP2-1PG/1UP2-1PG_decoys.pdbqt | data/1U/1UP2-1PG/1UP2-1PG_decoy_scores.csv |
1USI-PHE | data/1U/1USI-PHE/1USI-PHE_ligand.pdbqt | data/1U/1USI-PHE/1USI-PHE_target.pdbqt | data/1U/1USI-PHE/1USI-PHE_decoys.pdbqt | data/1U/1USI-PHE/1USI-PHE_decoy_scores.csv |
1U3Q-272 | data/1U/1U3Q-272/1U3Q-272_ligand.pdbqt | data/1U/1U3Q-272/1U3Q-272_target.pdbqt | data/1U/1U3Q-272/1U3Q-272_decoys.pdbqt | data/1U/1U3Q-272/1U3Q-272_decoy_scores.csv |
1UY6-PU3 | data/1U/1UY6-PU3/1UY6-PU3_ligand.pdbqt | data/1U/1UY6-PU3/1UY6-PU3_target.pdbqt | data/1U/1UY6-PU3/1UY6-PU3_decoys.pdbqt | data/1U/1UY6-PU3/1UY6-PU3_decoy_scores.csv |
1UXH-NAD | data/1U/1UXH-NAD/1UXH-NAD_ligand.pdbqt | data/1U/1UXH-NAD/1UXH-NAD_target.pdbqt | data/1U/1UXH-NAD/1UXH-NAD_decoys.pdbqt | data/1U/1UXH-NAD/1UXH-NAD_decoy_scores.csv |
1UDB-NAD | data/1U/1UDB-NAD/1UDB-NAD_ligand.pdbqt | data/1U/1UDB-NAD/1UDB-NAD_target.pdbqt | data/1U/1UDB-NAD/1UDB-NAD_decoys.pdbqt | data/1U/1UDB-NAD/1UDB-NAD_decoy_scores.csv |
1UAY-ADN | data/1U/1UAY-ADN/1UAY-ADN_ligand.pdbqt | data/1U/1UAY-ADN/1UAY-ADN_target.pdbqt | data/1U/1UAY-ADN/1UAY-ADN_decoys.pdbqt | data/1U/1UAY-ADN/1UAY-ADN_decoy_scores.csv |
1UZW-CDH | data/1U/1UZW-CDH/1UZW-CDH_ligand.pdbqt | data/1U/1UZW-CDH/1UZW-CDH_target.pdbqt | data/1U/1UZW-CDH/1UZW-CDH_decoys.pdbqt | data/1U/1UZW-CDH/1UZW-CDH_decoy_scores.csv |
1USC-FMN | data/1U/1USC-FMN/1USC-FMN_ligand.pdbqt | data/1U/1USC-FMN/1USC-FMN_target.pdbqt | data/1U/1USC-FMN/1USC-FMN_decoys.pdbqt | data/1U/1USC-FMN/1USC-FMN_decoy_scores.csv |
1U72-MTX | data/1U/1U72-MTX/1U72-MTX_ligand.pdbqt | data/1U/1U72-MTX/1U72-MTX_target.pdbqt | data/1U/1U72-MTX/1U72-MTX_decoys.pdbqt | data/1U/1U72-MTX/1U72-MTX_decoy_scores.csv |
1UVK-GTP | data/1U/1UVK-GTP/1UVK-GTP_ligand.pdbqt | data/1U/1UVK-GTP/1UVK-GTP_target.pdbqt | data/1U/1UVK-GTP/1UVK-GTP_decoys.pdbqt | data/1U/1UVK-GTP/1UVK-GTP_decoy_scores.csv |
1U59-STU | data/1U/1U59-STU/1U59-STU_ligand.pdbqt | data/1U/1U59-STU/1U59-STU_target.pdbqt | data/1U/1U59-STU/1U59-STU_decoys.pdbqt | data/1U/1U59-STU/1U59-STU_decoy_scores.csv |
1UQT-U2F | data/1U/1UQT-U2F/1UQT-U2F_ligand.pdbqt | data/1U/1UQT-U2F/1UQT-U2F_target.pdbqt | data/1U/1UQT-U2F/1UQT-U2F_decoys.pdbqt | data/1U/1UQT-U2F/1UQT-U2F_decoy_scores.csv |
1U4D-DBQ | data/1U/1U4D-DBQ/1U4D-DBQ_ligand.pdbqt | data/1U/1U4D-DBQ/1U4D-DBQ_target.pdbqt | data/1U/1U4D-DBQ/1U4D-DBQ_decoys.pdbqt | data/1U/1U4D-DBQ/1U4D-DBQ_decoy_scores.csv |
1U2G-APR | data/1U/1U2G-APR/1U2G-APR_ligand.pdbqt | data/1U/1U2G-APR/1U2G-APR_target.pdbqt | data/1U/1U2G-APR/1U2G-APR_decoys.pdbqt | data/1U/1U2G-APR/1U2G-APR_decoy_scores.csv |
1U7T-NAD | data/1U/1U7T-NAD/1U7T-NAD_ligand.pdbqt | data/1U/1U7T-NAD/1U7T-NAD_target.pdbqt | data/1U/1U7T-NAD/1U7T-NAD_decoys.pdbqt | data/1U/1U7T-NAD/1U7T-NAD_decoy_scores.csv |
1UVC-STE | data/1U/1UVC-STE/1UVC-STE_ligand.pdbqt | data/1U/1UVC-STE/1UVC-STE_target.pdbqt | data/1U/1UVC-STE/1UVC-STE_decoys.pdbqt | data/1U/1UVC-STE/1UVC-STE_decoy_scores.csv |
1UZV-FUC | data/1U/1UZV-FUC/1UZV-FUC_ligand.pdbqt | data/1U/1UZV-FUC/1UZV-FUC_target.pdbqt | data/1U/1UZV-FUC/1UZV-FUC_decoys.pdbqt | data/1U/1UZV-FUC/1UZV-FUC_decoy_scores.csv |
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