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 ⌀ |
|---|---|---|---|---|
4YAI-NAI | data/4Y/4YAI-NAI/4YAI-NAI_ligand.pdbqt | data/4Y/4YAI-NAI/4YAI-NAI_target.pdbqt | data/4Y/4YAI-NAI/4YAI-NAI_decoys.pdbqt | data/4Y/4YAI-NAI/4YAI-NAI_decoy_scores.csv |
4YLU-R30 | data/4Y/4YLU-R30/4YLU-R30_ligand.pdbqt | data/4Y/4YLU-R30/4YLU-R30_target.pdbqt | data/4Y/4YLU-R30/4YLU-R30_decoys.pdbqt | data/4Y/4YLU-R30/4YLU-R30_decoy_scores.csv |
4Y30-49L | data/4Y/4Y30-49L/4Y30-49L_ligand.pdbqt | data/4Y/4Y30-49L/4Y30-49L_target.pdbqt | data/4Y/4Y30-49L/4Y30-49L_decoys.pdbqt | data/4Y/4Y30-49L/4Y30-49L_decoy_scores.csv |
4YOJ-RFM | data/4Y/4YOJ-RFM/4YOJ-RFM_ligand.pdbqt | data/4Y/4YOJ-RFM/4YOJ-RFM_target.pdbqt | data/4Y/4YOJ-RFM/4YOJ-RFM_decoys.pdbqt | data/4Y/4YOJ-RFM/4YOJ-RFM_decoy_scores.csv |
4YRQ-HIS | data/4Y/4YRQ-HIS/4YRQ-HIS_ligand.pdbqt | data/4Y/4YRQ-HIS/4YRQ-HIS_target.pdbqt | data/4Y/4YRQ-HIS/4YRQ-HIS_decoys.pdbqt | data/4Y/4YRQ-HIS/4YRQ-HIS_decoy_scores.csv |
4YZ4-SIA | data/4Y/4YZ4-SIA/4YZ4-SIA_ligand.pdbqt | data/4Y/4YZ4-SIA/4YZ4-SIA_target.pdbqt | data/4Y/4YZ4-SIA/4YZ4-SIA_decoys.pdbqt | data/4Y/4YZ4-SIA/4YZ4-SIA_decoy_scores.csv |
4YQ4-FLC | data/4Y/4YQ4-FLC/4YQ4-FLC_ligand.pdbqt | data/4Y/4YQ4-FLC/4YQ4-FLC_target.pdbqt | data/4Y/4YQ4-FLC/4YQ4-FLC_decoys.pdbqt | data/4Y/4YQ4-FLC/4YQ4-FLC_decoy_scores.csv |
4YKG-NAD | data/4Y/4YKG-NAD/4YKG-NAD_ligand.pdbqt | data/4Y/4YKG-NAD/4YKG-NAD_target.pdbqt | data/4Y/4YKG-NAD/4YKG-NAD_decoys.pdbqt | data/4Y/4YKG-NAD/4YKG-NAD_decoy_scores.csv |
4YRR-HIS | data/4Y/4YRR-HIS/4YRR-HIS_ligand.pdbqt | data/4Y/4YRR-HIS/4YRR-HIS_target.pdbqt | data/4Y/4YRR-HIS/4YRR-HIS_decoys.pdbqt | data/4Y/4YRR-HIS/4YRR-HIS_decoy_scores.csv |
4YAU-2AM | data/4Y/4YAU-2AM/4YAU-2AM_ligand.pdbqt | data/4Y/4YAU-2AM/4YAU-2AM_target.pdbqt | data/4Y/4YAU-2AM/4YAU-2AM_decoys.pdbqt | data/4Y/4YAU-2AM/4YAU-2AM_decoy_scores.csv |
4YKF-NAI | data/4Y/4YKF-NAI/4YKF-NAI_ligand.pdbqt | data/4Y/4YKF-NAI/4YKF-NAI_target.pdbqt | data/4Y/4YKF-NAI/4YKF-NAI_decoys.pdbqt | data/4Y/4YKF-NAI/4YKF-NAI_decoy_scores.csv |
4YO8-4EZ | data/4Y/4YO8-4EZ/4YO8-4EZ_ligand.pdbqt | data/4Y/4YO8-4EZ/4YO8-4EZ_target.pdbqt | data/4Y/4YO8-4EZ/4YO8-4EZ_decoys.pdbqt | data/4Y/4YO8-4EZ/4YO8-4EZ_decoy_scores.csv |
4YNE-4EK | data/4Y/4YNE-4EK/4YNE-4EK_ligand.pdbqt | data/4Y/4YNE-4EK/4YNE-4EK_target.pdbqt | data/4Y/4YNE-4EK/4YNE-4EK_decoys.pdbqt | data/4Y/4YNE-4EK/4YNE-4EK_decoy_scores.csv |
4Y5N-487 | data/4Y/4Y5N-487/4Y5N-487_ligand.pdbqt | data/4Y/4Y5N-487/4Y5N-487_target.pdbqt | data/4Y/4Y5N-487/4Y5N-487_decoys.pdbqt | data/4Y/4Y5N-487/4Y5N-487_decoy_scores.csv |
4YPQ-4F1 | data/4Y/4YPQ-4F1/4YPQ-4F1_ligand.pdbqt | data/4Y/4YPQ-4F1/4YPQ-4F1_target.pdbqt | data/4Y/4YPQ-4F1/4YPQ-4F1_decoys.pdbqt | data/4Y/4YPQ-4F1/4YPQ-4F1_decoy_scores.csv |
4Y9G-MKU | data/4Y/4Y9G-MKU/4Y9G-MKU_ligand.pdbqt | data/4Y/4Y9G-MKU/4Y9G-MKU_target.pdbqt | data/4Y/4Y9G-MKU/4Y9G-MKU_decoys.pdbqt | data/4Y/4Y9G-MKU/4Y9G-MKU_decoy_scores.csv |
4YW7-GAL | data/4Y/4YW7-GAL/4YW7-GAL_ligand.pdbqt | data/4Y/4YW7-GAL/4YW7-GAL_target.pdbqt | data/4Y/4YW7-GAL/4YW7-GAL_decoys.pdbqt | data/4Y/4YW7-GAL/4YW7-GAL_decoy_scores.csv |
4Y5B-47P | data/4Y/4Y5B-47P/4Y5B-47P_ligand.pdbqt | data/4Y/4Y5B-47P/4Y5B-47P_target.pdbqt | data/4Y/4Y5B-47P/4Y5B-47P_decoys.pdbqt | data/4Y/4Y5B-47P/4Y5B-47P_decoy_scores.csv |
4YIL-4D3 | data/4Y/4YIL-4D3/4YIL-4D3_ligand.pdbqt | data/4Y/4YIL-4D3/4YIL-4D3_target.pdbqt | data/4Y/4YIL-4D3/4YIL-4D3_decoys.pdbqt | data/4Y/4YIL-4D3/4YIL-4D3_decoy_scores.csv |
4YDX-TCE | data/4Y/4YDX-TCE/4YDX-TCE_ligand.pdbqt | data/4Y/4YDX-TCE/4YDX-TCE_target.pdbqt | null | null |
4YQO-4H1 | data/4Y/4YQO-4H1/4YQO-4H1_ligand.pdbqt | data/4Y/4YQO-4H1/4YQO-4H1_target.pdbqt | data/4Y/4YQO-4H1/4YQO-4H1_decoys.pdbqt | data/4Y/4YQO-4H1/4YQO-4H1_decoy_scores.csv |
4YJQ-4DK | data/4Y/4YJQ-4DK/4YJQ-4DK_ligand.pdbqt | data/4Y/4YJQ-4DK/4YJQ-4DK_target.pdbqt | data/4Y/4YJQ-4DK/4YJQ-4DK_decoys.pdbqt | data/4Y/4YJQ-4DK/4YJQ-4DK_decoy_scores.csv |
4Y4N-48H | data/4Y/4Y4N-48H/4Y4N-48H_ligand.pdbqt | data/4Y/4Y4N-48H/4Y4N-48H_target.pdbqt | data/4Y/4Y4N-48H/4Y4N-48H_decoys.pdbqt | data/4Y/4Y4N-48H/4Y4N-48H_decoy_scores.csv |
4Y9R-FMN | data/4Y/4Y9R-FMN/4Y9R-FMN_ligand.pdbqt | data/4Y/4Y9R-FMN/4Y9R-FMN_target.pdbqt | data/4Y/4Y9R-FMN/4Y9R-FMN_decoys.pdbqt | data/4Y/4Y9R-FMN/4Y9R-FMN_decoy_scores.csv |
4YZC-STU | data/4Y/4YZC-STU/4YZC-STU_ligand.pdbqt | data/4Y/4YZC-STU/4YZC-STU_target.pdbqt | data/4Y/4YZC-STU/4YZC-STU_decoys.pdbqt | data/4Y/4YZC-STU/4YZC-STU_decoy_scores.csv |
4Y4X-47Q | data/4Y/4Y4X-47Q/4Y4X-47Q_ligand.pdbqt | data/4Y/4Y4X-47Q/4Y4X-47Q_target.pdbqt | data/4Y/4Y4X-47Q/4Y4X-47Q_decoys.pdbqt | data/4Y/4Y4X-47Q/4Y4X-47Q_decoy_scores.csv |
4YTR-TGJ | data/4Y/4YTR-TGJ/4YTR-TGJ_ligand.pdbqt | data/4Y/4YTR-TGJ/4YTR-TGJ_target.pdbqt | data/4Y/4YTR-TGJ/4YTR-TGJ_decoys.pdbqt | data/4Y/4YTR-TGJ/4YTR-TGJ_decoy_scores.csv |
4YV0-4JW | data/4Y/4YV0-4JW/4YV0-4JW_ligand.pdbqt | data/4Y/4YV0-4JW/4YV0-4JW_target.pdbqt | data/4Y/4YV0-4JW/4YV0-4JW_decoys.pdbqt | data/4Y/4YV0-4JW/4YV0-4JW_decoy_scores.csv |
4YMH-SAH | data/4Y/4YMH-SAH/4YMH-SAH_ligand.pdbqt | data/4Y/4YMH-SAH/4YMH-SAH_target.pdbqt | data/4Y/4YMH-SAH/4YMH-SAH_decoys.pdbqt | data/4Y/4YMH-SAH/4YMH-SAH_decoy_scores.csv |
4YAF-2AM | data/4Y/4YAF-2AM/4YAF-2AM_ligand.pdbqt | data/4Y/4YAF-2AM/4YAF-2AM_target.pdbqt | data/4Y/4YAF-2AM/4YAF-2AM_decoys.pdbqt | data/4Y/4YAF-2AM/4YAF-2AM_decoy_scores.csv |
4YBT-4BV | data/4Y/4YBT-4BV/4YBT-4BV_ligand.pdbqt | data/4Y/4YBT-4BV/4YBT-4BV_target.pdbqt | data/4Y/4YBT-4BV/4YBT-4BV_decoys.pdbqt | data/4Y/4YBT-4BV/4YBT-4BV_decoy_scores.csv |
4YUA-REF | data/4Y/4YUA-REF/4YUA-REF_ligand.pdbqt | data/4Y/4YUA-REF/4YUA-REF_target.pdbqt | data/4Y/4YUA-REF/4YUA-REF_decoys.pdbqt | data/4Y/4YUA-REF/4YUA-REF_decoy_scores.csv |
4YX6-FMN | data/4Y/4YX6-FMN/4YX6-FMN_ligand.pdbqt | data/4Y/4YX6-FMN/4YX6-FMN_target.pdbqt | data/4Y/4YX6-FMN/4YX6-FMN_decoys.pdbqt | data/4Y/4YX6-FMN/4YX6-FMN_decoy_scores.csv |
4Y36-45L | data/4Y/4Y36-45L/4Y36-45L_ligand.pdbqt | data/4Y/4Y36-45L/4Y36-45L_target.pdbqt | data/4Y/4Y36-45L/4Y36-45L_decoys.pdbqt | data/4Y/4Y36-45L/4Y36-45L_decoy_scores.csv |
4YUX-S4M | data/4Y/4YUX-S4M/4YUX-S4M_ligand.pdbqt | data/4Y/4YUX-S4M/4YUX-S4M_target.pdbqt | data/4Y/4YUX-S4M/4YUX-S4M_decoys.pdbqt | data/4Y/4YUX-S4M/4YUX-S4M_decoy_scores.csv |
4Y2V-4A5 | data/4Y/4Y2V-4A5/4Y2V-4A5_ligand.pdbqt | data/4Y/4Y2V-4A5/4Y2V-4A5_target.pdbqt | data/4Y/4Y2V-4A5/4Y2V-4A5_decoys.pdbqt | data/4Y/4Y2V-4A5/4Y2V-4A5_decoy_scores.csv |
4YMX-ARG | data/4Y/4YMX-ARG/4YMX-ARG_ligand.pdbqt | data/4Y/4YMX-ARG/4YMX-ARG_target.pdbqt | data/4Y/4YMX-ARG/4YMX-ARG_decoys.pdbqt | data/4Y/4YMX-ARG/4YMX-ARG_decoy_scores.csv |
4YVZ-3AT | data/4Y/4YVZ-3AT/4YVZ-3AT_ligand.pdbqt | data/4Y/4YVZ-3AT/4YVZ-3AT_target.pdbqt | data/4Y/4YVZ-3AT/4YVZ-3AT_decoys.pdbqt | data/4Y/4YVZ-3AT/4YVZ-3AT_decoy_scores.csv |
4YFQ-RET | data/4Y/4YFQ-RET/4YFQ-RET_ligand.pdbqt | data/4Y/4YFQ-RET/4YFQ-RET_target.pdbqt | data/4Y/4YFQ-RET/4YFQ-RET_decoys.pdbqt | data/4Y/4YFQ-RET/4YFQ-RET_decoy_scores.csv |
4YVH-SFG | data/4Y/4YVH-SFG/4YVH-SFG_ligand.pdbqt | data/4Y/4YVH-SFG/4YVH-SFG_target.pdbqt | data/4Y/4YVH-SFG/4YVH-SFG_decoys.pdbqt | data/4Y/4YVH-SFG/4YVH-SFG_decoy_scores.csv |
4YQ0-4FM | data/4Y/4YQ0-4FM/4YQ0-4FM_ligand.pdbqt | data/4Y/4YQ0-4FM/4YQ0-4FM_target.pdbqt | data/4Y/4YQ0-4FM/4YQ0-4FM_decoys.pdbqt | data/4Y/4YQ0-4FM/4YQ0-4FM_decoy_scores.csv |
4Y47-479 | data/4Y/4Y47-479/4Y47-479_ligand.pdbqt | data/4Y/4Y47-479/4Y47-479_target.pdbqt | data/4Y/4Y47-479/4Y47-479_decoys.pdbqt | data/4Y/4Y47-479/4Y47-479_decoy_scores.csv |
4YSW-URC | data/4Y/4YSW-URC/4YSW-URC_ligand.pdbqt | data/4Y/4YSW-URC/4YSW-URC_target.pdbqt | data/4Y/4YSW-URC/4YSW-URC_decoys.pdbqt | data/4Y/4YSW-URC/4YSW-URC_decoy_scores.csv |
4YIJ-THP | data/4Y/4YIJ-THP/4YIJ-THP_ligand.pdbqt | data/4Y/4YIJ-THP/4YIJ-THP_target.pdbqt | data/4Y/4YIJ-THP/4YIJ-THP_decoys.pdbqt | data/4Y/4YIJ-THP/4YIJ-THP_decoy_scores.csv |
4Y3R-F06 | data/4Y/4Y3R-F06/4Y3R-F06_ligand.pdbqt | data/4Y/4Y3R-F06/4Y3R-F06_target.pdbqt | data/4Y/4Y3R-F06/4Y3R-F06_decoys.pdbqt | data/4Y/4Y3R-F06/4Y3R-F06_decoy_scores.csv |
4YHS-BTB | data/4Y/4YHS-BTB/4YHS-BTB_ligand.pdbqt | data/4Y/4YHS-BTB/4YHS-BTB_target.pdbqt | data/4Y/4YHS-BTB/4YHS-BTB_decoys.pdbqt | data/4Y/4YHS-BTB/4YHS-BTB_decoy_scores.csv |
4YW1-SIA | data/4Y/4YW1-SIA/4YW1-SIA_ligand.pdbqt | data/4Y/4YW1-SIA/4YW1-SIA_target.pdbqt | data/4Y/4YW1-SIA/4YW1-SIA_decoys.pdbqt | data/4Y/4YW1-SIA/4YW1-SIA_decoy_scores.csv |
4Y3T-46H | data/4Y/4Y3T-46H/4Y3T-46H_ligand.pdbqt | data/4Y/4Y3T-46H/4Y3T-46H_target.pdbqt | data/4Y/4Y3T-46H/4Y3T-46H_decoys.pdbqt | data/4Y/4Y3T-46H/4Y3T-46H_decoy_scores.csv |
4Y44-46Y | data/4Y/4Y44-46Y/4Y44-46Y_ligand.pdbqt | data/4Y/4Y44-46Y/4Y44-46Y_target.pdbqt | data/4Y/4Y44-46Y/4Y44-46Y_decoys.pdbqt | data/4Y/4Y44-46Y/4Y44-46Y_decoy_scores.csv |
4YQ7-4G4 | data/4Y/4YQ7-4G4/4YQ7-4G4_ligand.pdbqt | data/4Y/4YQ7-4G4/4YQ7-4G4_target.pdbqt | data/4Y/4YQ7-4G4/4YQ7-4G4_decoys.pdbqt | data/4Y/4YQ7-4G4/4YQ7-4G4_decoy_scores.csv |
4Y6D-48U | data/4Y/4Y6D-48U/4Y6D-48U_ligand.pdbqt | data/4Y/4Y6D-48U/4Y6D-48U_target.pdbqt | data/4Y/4Y6D-48U/4Y6D-48U_decoys.pdbqt | data/4Y/4Y6D-48U/4Y6D-48U_decoy_scores.csv |
4YQV-4GG | data/4Y/4YQV-4GG/4YQV-4GG_ligand.pdbqt | data/4Y/4YQV-4GG/4YQV-4GG_target.pdbqt | data/4Y/4YQV-4GG/4YQV-4GG_decoys.pdbqt | data/4Y/4YQV-4GG/4YQV-4GG_decoy_scores.csv |
4YL1-4U8 | data/4Y/4YL1-4U8/4YL1-4U8_ligand.pdbqt | data/4Y/4YL1-4U8/4YL1-4U8_target.pdbqt | data/4Y/4YL1-4U8/4YL1-4U8_decoys.pdbqt | data/4Y/4YL1-4U8/4YL1-4U8_decoy_scores.csv |
4Y64-48C | data/4Y/4Y64-48C/4Y64-48C_ligand.pdbqt | data/4Y/4Y64-48C/4Y64-48C_target.pdbqt | data/4Y/4Y64-48C/4Y64-48C_decoys.pdbqt | data/4Y/4Y64-48C/4Y64-48C_decoy_scores.csv |
4Y0R-PX9 | data/4Y/4Y0R-PX9/4Y0R-PX9_ligand.pdbqt | data/4Y/4Y0R-PX9/4Y0R-PX9_target.pdbqt | data/4Y/4Y0R-PX9/4Y0R-PX9_decoys.pdbqt | data/4Y/4Y0R-PX9/4Y0R-PX9_decoy_scores.csv |
4YW9-1WD | data/4Y/4YW9-1WD/4YW9-1WD_ligand.pdbqt | data/4Y/4YW9-1WD/4YW9-1WD_target.pdbqt | data/4Y/4YW9-1WD/4YW9-1WD_decoys.pdbqt | data/4Y/4YW9-1WD/4YW9-1WD_decoy_scores.csv |
4YE3-G04 | data/4Y/4YE3-G04/4YE3-G04_ligand.pdbqt | data/4Y/4YE3-G04/4YE3-G04_target.pdbqt | null | null |
4Y62-48E | data/4Y/4Y62-48E/4Y62-48E_ligand.pdbqt | data/4Y/4Y62-48E/4Y62-48E_target.pdbqt | data/4Y/4Y62-48E/4Y62-48E_decoys.pdbqt | data/4Y/4Y62-48E/4Y62-48E_decoy_scores.csv |
4Y14-C0A | data/4Y/4Y14-C0A/4Y14-C0A_ligand.pdbqt | data/4Y/4Y14-C0A/4Y14-C0A_target.pdbqt | data/4Y/4Y14-C0A/4Y14-C0A_decoys.pdbqt | data/4Y/4Y14-C0A/4Y14-C0A_decoy_scores.csv |
4Y4T-46X | data/4Y/4Y4T-46X/4Y4T-46X_ligand.pdbqt | data/4Y/4Y4T-46X/4Y4T-46X_target.pdbqt | data/4Y/4Y4T-46X/4Y4T-46X_decoys.pdbqt | data/4Y/4Y4T-46X/4Y4T-46X_decoy_scores.csv |
4YJR-4DJ | data/4Y/4YJR-4DJ/4YJR-4DJ_ligand.pdbqt | data/4Y/4YJR-4DJ/4YJR-4DJ_target.pdbqt | data/4Y/4YJR-4DJ/4YJR-4DJ_decoys.pdbqt | data/4Y/4YJR-4DJ/4YJR-4DJ_decoy_scores.csv |
4YDQ-ANP | data/4Y/4YDQ-ANP/4YDQ-ANP_ligand.pdbqt | data/4Y/4YDQ-ANP/4YDQ-ANP_target.pdbqt | data/4Y/4YDQ-ANP/4YDQ-ANP_decoys.pdbqt | data/4Y/4YDQ-ANP/4YDQ-ANP_decoy_scores.csv |
4Y9U-FMN | data/4Y/4Y9U-FMN/4Y9U-FMN_ligand.pdbqt | data/4Y/4Y9U-FMN/4Y9U-FMN_target.pdbqt | data/4Y/4Y9U-FMN/4Y9U-FMN_decoys.pdbqt | data/4Y/4Y9U-FMN/4Y9U-FMN_decoy_scores.csv |
4Y0A-SKM | data/4Y/4Y0A-SKM/4Y0A-SKM_ligand.pdbqt | data/4Y/4Y0A-SKM/4Y0A-SKM_target.pdbqt | data/4Y/4Y0A-SKM/4Y0A-SKM_decoys.pdbqt | data/4Y/4Y0A-SKM/4Y0A-SKM_decoy_scores.csv |
4YPX-4FG | data/4Y/4YPX-4FG/4YPX-4FG_ligand.pdbqt | data/4Y/4YPX-4FG/4YPX-4FG_target.pdbqt | data/4Y/4YPX-4FG/4YPX-4FG_decoys.pdbqt | data/4Y/4YPX-4FG/4YPX-4FG_decoy_scores.csv |
4Y4B-47H | data/4Y/4Y4B-47H/4Y4B-47H_ligand.pdbqt | data/4Y/4Y4B-47H/4Y4B-47H_target.pdbqt | data/4Y/4Y4B-47H/4Y4B-47H_decoys.pdbqt | data/4Y/4Y4B-47H/4Y4B-47H_decoy_scores.csv |
4YPW-4FD | data/4Y/4YPW-4FD/4YPW-4FD_ligand.pdbqt | data/4Y/4YPW-4FD/4YPW-4FD_target.pdbqt | data/4Y/4YPW-4FD/4YPW-4FD_decoys.pdbqt | data/4Y/4YPW-4FD/4YPW-4FD_decoy_scores.csv |
4YO6-4GD | data/4Y/4YO6-4GD/4YO6-4GD_ligand.pdbqt | data/4Y/4YO6-4GD/4YO6-4GD_target.pdbqt | data/4Y/4YO6-4GD/4YO6-4GD_decoys.pdbqt | data/4Y/4YO6-4GD/4YO6-4GD_decoy_scores.csv |
4YZ7-PE4 | data/4Y/4YZ7-PE4/4YZ7-PE4_ligand.pdbqt | data/4Y/4YZ7-PE4/4YZ7-PE4_target.pdbqt | data/4Y/4YZ7-PE4/4YZ7-PE4_decoys.pdbqt | data/4Y/4YZ7-PE4/4YZ7-PE4_decoy_scores.csv |
4YH3-Y80 | data/4Y/4YH3-Y80/4YH3-Y80_ligand.pdbqt | data/4Y/4YH3-Y80/4YH3-Y80_target.pdbqt | data/4Y/4YH3-Y80/4YH3-Y80_decoys.pdbqt | data/4Y/4YH3-Y80/4YH3-Y80_decoy_scores.csv |
4YJI-TYL | data/4Y/4YJI-TYL/4YJI-TYL_ligand.pdbqt | data/4Y/4YJI-TYL/4YJI-TYL_target.pdbqt | data/4Y/4YJI-TYL/4YJI-TYL_decoys.pdbqt | data/4Y/4YJI-TYL/4YJI-TYL_decoy_scores.csv |
4YBS-4BK | data/4Y/4YBS-4BK/4YBS-4BK_ligand.pdbqt | data/4Y/4YBS-4BK/4YBS-4BK_target.pdbqt | data/4Y/4YBS-4BK/4YBS-4BK_decoys.pdbqt | data/4Y/4YBS-4BK/4YBS-4BK_decoy_scores.csv |
4Y5K-489 | data/4Y/4Y5K-489/4Y5K-489_ligand.pdbqt | data/4Y/4Y5K-489/4Y5K-489_target.pdbqt | data/4Y/4Y5K-489/4Y5K-489_decoys.pdbqt | data/4Y/4Y5K-489/4Y5K-489_decoy_scores.csv |
4Y4D-CFF | data/4Y/4Y4D-CFF/4Y4D-CFF_ligand.pdbqt | data/4Y/4Y4D-CFF/4Y4D-CFF_target.pdbqt | data/4Y/4Y4D-CFF/4Y4D-CFF_decoys.pdbqt | data/4Y/4Y4D-CFF/4Y4D-CFF_decoy_scores.csv |
4Y9C-MKS | data/4Y/4Y9C-MKS/4Y9C-MKS_ligand.pdbqt | data/4Y/4Y9C-MKS/4Y9C-MKS_target.pdbqt | data/4Y/4Y9C-MKS/4Y9C-MKS_decoys.pdbqt | data/4Y/4Y9C-MKS/4Y9C-MKS_decoy_scores.csv |
4YTT-PUF | data/4Y/4YTT-PUF/4YTT-PUF_ligand.pdbqt | data/4Y/4YTT-PUF/4YTT-PUF_target.pdbqt | data/4Y/4YTT-PUF/4YTT-PUF_decoys.pdbqt | data/4Y/4YTT-PUF/4YTT-PUF_decoy_scores.csv |
4YKM-RET | data/4Y/4YKM-RET/4YKM-RET_ligand.pdbqt | data/4Y/4YKM-RET/4YKM-RET_target.pdbqt | data/4Y/4YKM-RET/4YKM-RET_decoys.pdbqt | data/4Y/4YKM-RET/4YKM-RET_decoy_scores.csv |
4Y5C-47V | data/4Y/4Y5C-47V/4Y5C-47V_ligand.pdbqt | data/4Y/4Y5C-47V/4Y5C-47V_target.pdbqt | data/4Y/4Y5C-47V/4Y5C-47V_decoys.pdbqt | data/4Y/4Y5C-47V/4Y5C-47V_decoy_scores.csv |
4YAL-FMN | data/4Y/4YAL-FMN/4YAL-FMN_ligand.pdbqt | data/4Y/4YAL-FMN/4YAL-FMN_target.pdbqt | data/4Y/4YAL-FMN/4YAL-FMN_decoys.pdbqt | data/4Y/4YAL-FMN/4YAL-FMN_decoy_scores.csv |
4YUZ-S4M | data/4Y/4YUZ-S4M/4YUZ-S4M_ligand.pdbqt | data/4Y/4YUZ-S4M/4YUZ-S4M_target.pdbqt | data/4Y/4YUZ-S4M/4YUZ-S4M_decoys.pdbqt | data/4Y/4YUZ-S4M/4YUZ-S4M_decoy_scores.csv |
4YYY-URI | data/4Y/4YYY-URI/4YYY-URI_ligand.pdbqt | data/4Y/4YYY-URI/4YYY-URI_target.pdbqt | data/4Y/4YYY-URI/4YYY-URI_decoys.pdbqt | data/4Y/4YYY-URI/4YYY-URI_decoy_scores.csv |
4YZ3-G39 | data/4Y/4YZ3-G39/4YZ3-G39_ligand.pdbqt | data/4Y/4YZ3-G39/4YZ3-G39_target.pdbqt | data/4Y/4YZ3-G39/4YZ3-G39_decoys.pdbqt | data/4Y/4YZ3-G39/4YZ3-G39_decoy_scores.csv |
4YV2-S4M | data/4Y/4YV2-S4M/4YV2-S4M_ligand.pdbqt | data/4Y/4YV2-S4M/4YV2-S4M_target.pdbqt | data/4Y/4YV2-S4M/4YV2-S4M_decoys.pdbqt | data/4Y/4YV2-S4M/4YV2-S4M_decoy_scores.csv |
4YHQ-G10 | data/4Y/4YHQ-G10/4YHQ-G10_ligand.pdbqt | data/4Y/4YHQ-G10/4YHQ-G10_target.pdbqt | null | null |
4Y4J-LNR | data/4Y/4Y4J-LNR/4Y4J-LNR_ligand.pdbqt | data/4Y/4Y4J-LNR/4Y4J-LNR_target.pdbqt | data/4Y/4Y4J-LNR/4Y4J-LNR_decoys.pdbqt | data/4Y/4Y4J-LNR/4Y4J-LNR_decoy_scores.csv |
4Y5A-47M | data/4Y/4Y5A-47M/4Y5A-47M_ligand.pdbqt | data/4Y/4Y5A-47M/4Y5A-47M_target.pdbqt | data/4Y/4Y5A-47M/4Y5A-47M_decoys.pdbqt | data/4Y/4Y5A-47M/4Y5A-47M_decoy_scores.csv |
4Y64-BHE | data/4Y/4Y64-BHE/4Y64-BHE_ligand.pdbqt | data/4Y/4Y64-BHE/4Y64-BHE_target.pdbqt | data/4Y/4Y64-BHE/4Y64-BHE_decoys.pdbqt | data/4Y/4Y64-BHE/4Y64-BHE_decoy_scores.csv |
4YU7-DHC | data/4Y/4YU7-DHC/4YU7-DHC_ligand.pdbqt | data/4Y/4YU7-DHC/4YU7-DHC_target.pdbqt | data/4Y/4YU7-DHC/4YU7-DHC_decoys.pdbqt | data/4Y/4YU7-DHC/4YU7-DHC_decoy_scores.csv |
4Y30-SAH | data/4Y/4Y30-SAH/4Y30-SAH_ligand.pdbqt | data/4Y/4Y30-SAH/4Y30-SAH_target.pdbqt | data/4Y/4Y30-SAH/4Y30-SAH_decoys.pdbqt | data/4Y/4Y30-SAH/4Y30-SAH_decoy_scores.csv |
4Y29-CTI | data/4Y/4Y29-CTI/4Y29-CTI_ligand.pdbqt | data/4Y/4Y29-CTI/4Y29-CTI_target.pdbqt | data/4Y/4Y29-CTI/4Y29-CTI_decoys.pdbqt | data/4Y/4Y29-CTI/4Y29-CTI_decoy_scores.csv |
4Y03-SAL | data/4Y/4Y03-SAL/4Y03-SAL_ligand.pdbqt | data/4Y/4Y03-SAL/4Y03-SAL_target.pdbqt | data/4Y/4Y03-SAL/4Y03-SAL_decoys.pdbqt | data/4Y/4Y03-SAL/4Y03-SAL_decoy_scores.csv |
4Y57-F63 | data/4Y/4Y57-F63/4Y57-F63_ligand.pdbqt | data/4Y/4Y57-F63/4Y57-F63_target.pdbqt | data/4Y/4Y57-F63/4Y57-F63_decoys.pdbqt | data/4Y/4Y57-F63/4Y57-F63_decoy_scores.csv |
4YQ6-4FX | data/4Y/4YQ6-4FX/4YQ6-4FX_ligand.pdbqt | data/4Y/4YQ6-4FX/4YQ6-4FX_target.pdbqt | data/4Y/4YQ6-4FX/4YQ6-4FX_decoys.pdbqt | data/4Y/4YQ6-4FX/4YQ6-4FX_decoy_scores.csv |
4Y8Z-4CE | data/4Y/4Y8Z-4CE/4Y8Z-4CE_ligand.pdbqt | data/4Y/4Y8Z-4CE/4Y8Z-4CE_target.pdbqt | data/4Y/4Y8Z-4CE/4Y8Z-4CE_decoys.pdbqt | data/4Y/4Y8Z-4CE/4Y8Z-4CE_decoy_scores.csv |
4Y79-4O6 | data/4Y/4Y79-4O6/4Y79-4O6_ligand.pdbqt | data/4Y/4Y79-4O6/4Y79-4O6_target.pdbqt | data/4Y/4Y79-4O6/4Y79-4O6_decoys.pdbqt | data/4Y/4Y79-4O6/4Y79-4O6_decoy_scores.csv |
4YIW-NCD | data/4Y/4YIW-NCD/4YIW-NCD_ligand.pdbqt | data/4Y/4YIW-NCD/4YIW-NCD_target.pdbqt | data/4Y/4YIW-NCD/4YIW-NCD_decoys.pdbqt | data/4Y/4YIW-NCD/4YIW-NCD_decoy_scores.csv |
4YD7-F5N | data/4Y/4YD7-F5N/4YD7-F5N_ligand.pdbqt | data/4Y/4YD7-F5N/4YD7-F5N_target.pdbqt | data/4Y/4YD7-F5N/4YD7-F5N_decoys.pdbqt | data/4Y/4YD7-F5N/4YD7-F5N_decoy_scores.csv |
4YNM-SAM | data/4Y/4YNM-SAM/4YNM-SAM_ligand.pdbqt | data/4Y/4YNM-SAM/4YNM-SAM_target.pdbqt | data/4Y/4YNM-SAM/4YNM-SAM_decoys.pdbqt | data/4Y/4YNM-SAM/4YNM-SAM_decoy_scores.csv |
4Y62-BHE | data/4Y/4Y62-BHE/4Y62-BHE_ligand.pdbqt | data/4Y/4Y62-BHE/4Y62-BHE_target.pdbqt | data/4Y/4Y62-BHE/4Y62-BHE_decoys.pdbqt | data/4Y/4Y62-BHE/4Y62-BHE_decoy_scores.csv |
4YOA-017 | data/4Y/4YOA-017/4YOA-017_ligand.pdbqt | data/4Y/4YOA-017/4YOA-017_target.pdbqt | data/4Y/4YOA-017/4YOA-017_decoys.pdbqt | data/4Y/4YOA-017/4YOA-017_decoy_scores.csv |
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