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 ⌀ |
|---|---|---|---|---|
5SAT-ZSY | data/5S/5SAT-ZSY/5SAT-ZSY_ligand.pdbqt | data/5S/5SAT-ZSY/5SAT-ZSY_target.pdbqt | data/5S/5SAT-ZSY/5SAT-ZSY_decoys.pdbqt | data/5S/5SAT-ZSY/5SAT-ZSY_decoy_scores.csv |
5S55-GTP | data/5S/5S55-GTP/5S55-GTP_ligand.pdbqt | data/5S/5S55-GTP/5S55-GTP_target.pdbqt | data/5S/5S55-GTP/5S55-GTP_decoys.pdbqt | data/5S/5S55-GTP/5S55-GTP_decoy_scores.csv |
5SIW-JTX | data/5S/5SIW-JTX/5SIW-JTX_ligand.pdbqt | data/5S/5SIW-JTX/5SIW-JTX_target.pdbqt | data/5S/5SIW-JTX/5SIW-JTX_decoys.pdbqt | data/5S/5SIW-JTX/5SIW-JTX_decoy_scores.csv |
5SAQ-ZSJ | data/5S/5SAQ-ZSJ/5SAQ-ZSJ_ligand.pdbqt | data/5S/5SAQ-ZSJ/5SAQ-ZSJ_target.pdbqt | data/5S/5SAQ-ZSJ/5SAQ-ZSJ_decoys.pdbqt | data/5S/5SAQ-ZSJ/5SAQ-ZSJ_decoy_scores.csv |
5SGN-IY6 | data/5S/5SGN-IY6/5SGN-IY6_ligand.pdbqt | data/5S/5SGN-IY6/5SGN-IY6_target.pdbqt | data/5S/5SGN-IY6/5SGN-IY6_decoys.pdbqt | data/5S/5SGN-IY6/5SGN-IY6_decoy_scores.csv |
5ST4-UWR | data/5S/5ST4-UWR/5ST4-UWR_ligand.pdbqt | data/5S/5ST4-UWR/5ST4-UWR_target.pdbqt | data/5S/5ST4-UWR/5ST4-UWR_decoys.pdbqt | data/5S/5ST4-UWR/5ST4-UWR_decoy_scores.csv |
5S5Y-ACP | data/5S/5S5Y-ACP/5S5Y-ACP_ligand.pdbqt | data/5S/5S5Y-ACP/5S5Y-ACP_target.pdbqt | data/5S/5S5Y-ACP/5S5Y-ACP_decoys.pdbqt | data/5S/5S5Y-ACP/5S5Y-ACP_decoy_scores.csv |
5SIA-JNL | data/5S/5SIA-JNL/5SIA-JNL_ligand.pdbqt | data/5S/5SIA-JNL/5SIA-JNL_target.pdbqt | data/5S/5SIA-JNL/5SIA-JNL_decoys.pdbqt | data/5S/5SIA-JNL/5SIA-JNL_decoy_scores.csv |
5S4Y-ACP | data/5S/5S4Y-ACP/5S4Y-ACP_ligand.pdbqt | data/5S/5S4Y-ACP/5S4Y-ACP_target.pdbqt | data/5S/5S4Y-ACP/5S4Y-ACP_decoys.pdbqt | data/5S/5S4Y-ACP/5S4Y-ACP_decoy_scores.csv |
5SCL-AZN | data/5S/5SCL-AZN/5SCL-AZN_ligand.pdbqt | data/5S/5SCL-AZN/5SCL-AZN_target.pdbqt | data/5S/5SCL-AZN/5SCL-AZN_decoys.pdbqt | data/5S/5SCL-AZN/5SCL-AZN_decoy_scores.csv |
5SKI-KFX | data/5S/5SKI-KFX/5SKI-KFX_ligand.pdbqt | data/5S/5SKI-KFX/5SKI-KFX_target.pdbqt | data/5S/5SKI-KFX/5SKI-KFX_decoys.pdbqt | data/5S/5SKI-KFX/5SKI-KFX_decoy_scores.csv |
5SBS-8AK | data/5S/5SBS-8AK/5SBS-8AK_ligand.pdbqt | data/5S/5SBS-8AK/5SBS-8AK_target.pdbqt | data/5S/5SBS-8AK/5SBS-8AK_decoys.pdbqt | data/5S/5SBS-8AK/5SBS-8AK_decoy_scores.csv |
5SI4-JLR | data/5S/5SI4-JLR/5SI4-JLR_ligand.pdbqt | data/5S/5SI4-JLR/5SI4-JLR_target.pdbqt | data/5S/5SI4-JLR/5SI4-JLR_decoys.pdbqt | data/5S/5SI4-JLR/5SI4-JLR_decoy_scores.csv |
5SA7-WL7 | data/5S/5SA7-WL7/5SA7-WL7_ligand.pdbqt | data/5S/5SA7-WL7/5SA7-WL7_target.pdbqt | data/5S/5SA7-WL7/5SA7-WL7_decoys.pdbqt | data/5S/5SA7-WL7/5SA7-WL7_decoy_scores.csv |
5S5C-ACP | data/5S/5S5C-ACP/5S5C-ACP_ligand.pdbqt | data/5S/5S5C-ACP/5S5C-ACP_target.pdbqt | data/5S/5S5C-ACP/5S5C-ACP_decoys.pdbqt | data/5S/5S5C-ACP/5S5C-ACP_decoy_scores.csv |
5S5J-GTP | data/5S/5S5J-GTP/5S5J-GTP_ligand.pdbqt | data/5S/5S5J-GTP/5S5J-GTP_target.pdbqt | data/5S/5S5J-GTP/5S5J-GTP_decoys.pdbqt | data/5S/5S5J-GTP/5S5J-GTP_decoy_scores.csv |
5STB-V99 | data/5S/5STB-V99/5STB-V99_ligand.pdbqt | data/5S/5STB-V99/5STB-V99_target.pdbqt | data/5S/5STB-V99/5STB-V99_decoys.pdbqt | data/5S/5STB-V99/5STB-V99_decoy_scores.csv |
5S4Z-ACP | data/5S/5S4Z-ACP/5S4Z-ACP_ligand.pdbqt | data/5S/5S4Z-ACP/5S4Z-ACP_target.pdbqt | data/5S/5S4Z-ACP/5S4Z-ACP_decoys.pdbqt | data/5S/5S4Z-ACP/5S4Z-ACP_decoy_scores.csv |
5SLB-LJK | data/5S/5SLB-LJK/5SLB-LJK_ligand.pdbqt | data/5S/5SLB-LJK/5SLB-LJK_target.pdbqt | data/5S/5SLB-LJK/5SLB-LJK_decoys.pdbqt | data/5S/5SLB-LJK/5SLB-LJK_decoy_scores.csv |
5SL7-W0G | data/5S/5SL7-W0G/5SL7-W0G_ligand.pdbqt | data/5S/5SL7-W0G/5SL7-W0G_target.pdbqt | data/5S/5SL7-W0G/5SL7-W0G_decoys.pdbqt | data/5S/5SL7-W0G/5SL7-W0G_decoy_scores.csv |
5SC1-8DH | data/5S/5SC1-8DH/5SC1-8DH_ligand.pdbqt | data/5S/5SC1-8DH/5SC1-8DH_target.pdbqt | data/5S/5SC1-8DH/5SC1-8DH_decoys.pdbqt | data/5S/5SC1-8DH/5SC1-8DH_decoy_scores.csv |
5SCP-GWL | data/5S/5SCP-GWL/5SCP-GWL_ligand.pdbqt | data/5S/5SCP-GWL/5SCP-GWL_target.pdbqt | data/5S/5SCP-GWL/5SCP-GWL_decoys.pdbqt | data/5S/5SCP-GWL/5SCP-GWL_decoy_scores.csv |
5SU8-V40 | data/5S/5SU8-V40/5SU8-V40_ligand.pdbqt | data/5S/5SU8-V40/5SU8-V40_target.pdbqt | data/5S/5SU8-V40/5SU8-V40_decoys.pdbqt | data/5S/5SU8-V40/5SU8-V40_decoy_scores.csv |
5SKQ-KIE | data/5S/5SKQ-KIE/5SKQ-KIE_ligand.pdbqt | data/5S/5SKQ-KIE/5SKQ-KIE_target.pdbqt | data/5S/5SKQ-KIE/5SKQ-KIE_decoys.pdbqt | data/5S/5SKQ-KIE/5SKQ-KIE_decoy_scores.csv |
5SM4-AWD | data/5S/5SM4-AWD/5SM4-AWD_ligand.pdbqt | data/5S/5SM4-AWD/5SM4-AWD_target.pdbqt | data/5S/5SM4-AWD/5SM4-AWD_decoys.pdbqt | data/5S/5SM4-AWD/5SM4-AWD_decoy_scores.csv |
5SC5-VZY | data/5S/5SC5-VZY/5SC5-VZY_ligand.pdbqt | data/5S/5SC5-VZY/5SC5-VZY_target.pdbqt | data/5S/5SC5-VZY/5SC5-VZY_decoys.pdbqt | data/5S/5SC5-VZY/5SC5-VZY_decoy_scores.csv |
5S37-NZ1 | data/5S/5S37-NZ1/5S37-NZ1_ligand.pdbqt | data/5S/5S37-NZ1/5S37-NZ1_target.pdbqt | data/5S/5S37-NZ1/5S37-NZ1_decoys.pdbqt | data/5S/5S37-NZ1/5S37-NZ1_decoy_scores.csv |
5SAB-WJD | data/5S/5SAB-WJD/5SAB-WJD_ligand.pdbqt | data/5S/5SAB-WJD/5SAB-WJD_target.pdbqt | data/5S/5SAB-WJD/5SAB-WJD_decoys.pdbqt | data/5S/5SAB-WJD/5SAB-WJD_decoy_scores.csv |
5SC0-T0Y | data/5S/5SC0-T0Y/5SC0-T0Y_ligand.pdbqt | data/5S/5SC0-T0Y/5SC0-T0Y_target.pdbqt | data/5S/5SC0-T0Y/5SC0-T0Y_decoys.pdbqt | data/5S/5SC0-T0Y/5SC0-T0Y_decoy_scores.csv |
5SH5-J6I | data/5S/5SH5-J6I/5SH5-J6I_ligand.pdbqt | data/5S/5SH5-J6I/5SH5-J6I_target.pdbqt | data/5S/5SH5-J6I/5SH5-J6I_decoys.pdbqt | data/5S/5SH5-J6I/5SH5-J6I_decoy_scores.csv |
5SCQ-GXC | data/5S/5SCQ-GXC/5SCQ-GXC_ligand.pdbqt | data/5S/5SCQ-GXC/5SCQ-GXC_target.pdbqt | data/5S/5SCQ-GXC/5SCQ-GXC_decoys.pdbqt | data/5S/5SCQ-GXC/5SCQ-GXC_decoy_scores.csv |
5S2J-JGG | data/5S/5S2J-JGG/5S2J-JGG_ligand.pdbqt | data/5S/5S2J-JGG/5S2J-JGG_target.pdbqt | data/5S/5S2J-JGG/5S2J-JGG_decoys.pdbqt | data/5S/5S2J-JGG/5S2J-JGG_decoy_scores.csv |
5S3J-W1S | data/5S/5S3J-W1S/5S3J-W1S_ligand.pdbqt | data/5S/5S3J-W1S/5S3J-W1S_target.pdbqt | data/5S/5S3J-W1S/5S3J-W1S_decoys.pdbqt | data/5S/5S3J-W1S/5S3J-W1S_decoy_scores.csv |
5S4V-GDP | data/5S/5S4V-GDP/5S4V-GDP_ligand.pdbqt | data/5S/5S4V-GDP/5S4V-GDP_target.pdbqt | data/5S/5S4V-GDP/5S4V-GDP_decoys.pdbqt | data/5S/5S4V-GDP/5S4V-GDP_decoy_scores.csv |
5SLH-LLU | data/5S/5SLH-LLU/5SLH-LLU_ligand.pdbqt | data/5S/5SLH-LLU/5SLH-LLU_target.pdbqt | data/5S/5SLH-LLU/5SLH-LLU_decoys.pdbqt | data/5S/5SLH-LLU/5SLH-LLU_decoy_scores.csv |
5SUB-V6R | data/5S/5SUB-V6R/5SUB-V6R_ligand.pdbqt | data/5S/5SUB-V6R/5SUB-V6R_target.pdbqt | data/5S/5SUB-V6R/5SUB-V6R_decoys.pdbqt | data/5S/5SUB-V6R/5SUB-V6R_decoy_scores.csv |
5S45-W3D | data/5S/5S45-W3D/5S45-W3D_ligand.pdbqt | data/5S/5S45-W3D/5S45-W3D_target.pdbqt | data/5S/5S45-W3D/5S45-W3D_decoys.pdbqt | data/5S/5S45-W3D/5S45-W3D_decoy_scores.csv |
5SJC-K0R | data/5S/5SJC-K0R/5SJC-K0R_ligand.pdbqt | data/5S/5SJC-K0R/5SJC-K0R_target.pdbqt | data/5S/5SJC-K0R/5SJC-K0R_decoys.pdbqt | data/5S/5SJC-K0R/5SJC-K0R_decoy_scores.csv |
5SFL-IL9 | data/5S/5SFL-IL9/5SFL-IL9_ligand.pdbqt | data/5S/5SFL-IL9/5SFL-IL9_target.pdbqt | data/5S/5SFL-IL9/5SFL-IL9_decoys.pdbqt | data/5S/5SFL-IL9/5SFL-IL9_decoy_scores.csv |
5SK1-IKE | data/5S/5SK1-IKE/5SK1-IKE_ligand.pdbqt | data/5S/5SK1-IKE/5SK1-IKE_target.pdbqt | data/5S/5SK1-IKE/5SK1-IKE_decoys.pdbqt | data/5S/5SK1-IKE/5SK1-IKE_decoy_scores.csv |
5S8P-3PF | data/5S/5S8P-3PF/5S8P-3PF_ligand.pdbqt | data/5S/5S8P-3PF/5S8P-3PF_target.pdbqt | data/5S/5S8P-3PF/5S8P-3PF_decoys.pdbqt | data/5S/5S8P-3PF/5S8P-3PF_decoy_scores.csv |
5S2V-W0G | data/5S/5S2V-W0G/5S2V-W0G_ligand.pdbqt | data/5S/5S2V-W0G/5S2V-W0G_target.pdbqt | data/5S/5S2V-W0G/5S2V-W0G_decoys.pdbqt | data/5S/5S2V-W0G/5S2V-W0G_decoy_scores.csv |
5SEZ-IIU | data/5S/5SEZ-IIU/5SEZ-IIU_ligand.pdbqt | data/5S/5SEZ-IIU/5SEZ-IIU_target.pdbqt | data/5S/5SEZ-IIU/5SEZ-IIU_decoys.pdbqt | data/5S/5SEZ-IIU/5SEZ-IIU_decoy_scores.csv |
5SKR-KII | data/5S/5SKR-KII/5SKR-KII_ligand.pdbqt | data/5S/5SKR-KII/5SKR-KII_target.pdbqt | data/5S/5SKR-KII/5SKR-KII_decoys.pdbqt | data/5S/5SKR-KII/5SKR-KII_decoy_scores.csv |
5SAV-1IJ | data/5S/5SAV-1IJ/5SAV-1IJ_ligand.pdbqt | data/5S/5SAV-1IJ/5SAV-1IJ_target.pdbqt | data/5S/5SAV-1IJ/5SAV-1IJ_decoys.pdbqt | data/5S/5SAV-1IJ/5SAV-1IJ_decoy_scores.csv |
5S2P-W04 | data/5S/5S2P-W04/5S2P-W04_ligand.pdbqt | data/5S/5S2P-W04/5S2P-W04_target.pdbqt | data/5S/5S2P-W04/5S2P-W04_decoys.pdbqt | data/5S/5S2P-W04/5S2P-W04_decoy_scores.csv |
5S44-W3A | data/5S/5S44-W3A/5S44-W3A_ligand.pdbqt | data/5S/5S44-W3A/5S44-W3A_target.pdbqt | data/5S/5S44-W3A/5S44-W3A_decoys.pdbqt | data/5S/5S44-W3A/5S44-W3A_decoy_scores.csv |
5SHS-JIS | data/5S/5SHS-JIS/5SHS-JIS_ligand.pdbqt | data/5S/5SHS-JIS/5SHS-JIS_target.pdbqt | data/5S/5SHS-JIS/5SHS-JIS_decoys.pdbqt | data/5S/5SHS-JIS/5SHS-JIS_decoy_scores.csv |
5SJB-K0C | data/5S/5SJB-K0C/5SJB-K0C_ligand.pdbqt | data/5S/5SJB-K0C/5SJB-K0C_target.pdbqt | data/5S/5SJB-K0C/5SJB-K0C_decoys.pdbqt | data/5S/5SJB-K0C/5SJB-K0C_decoy_scores.csv |
5SGU-Z73 | data/5S/5SGU-Z73/5SGU-Z73_ligand.pdbqt | data/5S/5SGU-Z73/5SGU-Z73_target.pdbqt | data/5S/5SGU-Z73/5SGU-Z73_decoys.pdbqt | data/5S/5SGU-Z73/5SGU-Z73_decoy_scores.csv |
5SB4-ACP | data/5S/5SB4-ACP/5SB4-ACP_ligand.pdbqt | data/5S/5SB4-ACP/5SB4-ACP_target.pdbqt | data/5S/5SB4-ACP/5SB4-ACP_decoys.pdbqt | data/5S/5SB4-ACP/5SB4-ACP_decoy_scores.csv |
5S5L-GTP | data/5S/5S5L-GTP/5S5L-GTP_ligand.pdbqt | data/5S/5S5L-GTP/5S5L-GTP_target.pdbqt | data/5S/5S5L-GTP/5S5L-GTP_decoys.pdbqt | data/5S/5S5L-GTP/5S5L-GTP_decoy_scores.csv |
5SJR-K63 | data/5S/5SJR-K63/5SJR-K63_ligand.pdbqt | data/5S/5SJR-K63/5SJR-K63_target.pdbqt | data/5S/5SJR-K63/5SJR-K63_decoys.pdbqt | data/5S/5SJR-K63/5SJR-K63_decoy_scores.csv |
5STR-VNU | data/5S/5STR-VNU/5STR-VNU_ligand.pdbqt | data/5S/5STR-VNU/5STR-VNU_target.pdbqt | data/5S/5STR-VNU/5STR-VNU_decoys.pdbqt | data/5S/5STR-VNU/5STR-VNU_decoy_scores.csv |
5SXS-AMP | data/5S/5SXS-AMP/5SXS-AMP_ligand.pdbqt | data/5S/5SXS-AMP/5SXS-AMP_target.pdbqt | data/5S/5SXS-AMP/5SXS-AMP_decoys.pdbqt | data/5S/5SXS-AMP/5SXS-AMP_decoy_scores.csv |
5S9Q-YW7 | data/5S/5S9Q-YW7/5S9Q-YW7_ligand.pdbqt | data/5S/5S9Q-YW7/5S9Q-YW7_target.pdbqt | data/5S/5S9Q-YW7/5S9Q-YW7_decoys.pdbqt | data/5S/5S9Q-YW7/5S9Q-YW7_decoy_scores.csv |
5S56-O3G | data/5S/5S56-O3G/5S56-O3G_ligand.pdbqt | data/5S/5S56-O3G/5S56-O3G_target.pdbqt | data/5S/5S56-O3G/5S56-O3G_decoys.pdbqt | data/5S/5S56-O3G/5S56-O3G_decoy_scores.csv |
5S93-Y2J | data/5S/5S93-Y2J/5S93-Y2J_ligand.pdbqt | data/5S/5S93-Y2J/5S93-Y2J_target.pdbqt | data/5S/5S93-Y2J/5S93-Y2J_decoys.pdbqt | data/5S/5S93-Y2J/5S93-Y2J_decoy_scores.csv |
5SEX-II9 | data/5S/5SEX-II9/5SEX-II9_ligand.pdbqt | data/5S/5SEX-II9/5SEX-II9_target.pdbqt | data/5S/5SEX-II9/5SEX-II9_decoys.pdbqt | data/5S/5SEX-II9/5SEX-II9_decoy_scores.csv |
5S4V-ACP | data/5S/5S4V-ACP/5S4V-ACP_ligand.pdbqt | data/5S/5S4V-ACP/5S4V-ACP_target.pdbqt | data/5S/5S4V-ACP/5S4V-ACP_decoys.pdbqt | data/5S/5S4V-ACP/5S4V-ACP_decoy_scores.csv |
5S8X-34Z | data/5S/5S8X-34Z/5S8X-34Z_ligand.pdbqt | data/5S/5S8X-34Z/5S8X-34Z_target.pdbqt | data/5S/5S8X-34Z/5S8X-34Z_decoys.pdbqt | data/5S/5S8X-34Z/5S8X-34Z_decoy_scores.csv |
5S9Y-6SU | data/5S/5S9Y-6SU/5S9Y-6SU_ligand.pdbqt | data/5S/5S9Y-6SU/5S9Y-6SU_target.pdbqt | data/5S/5S9Y-6SU/5S9Y-6SU_decoys.pdbqt | data/5S/5S9Y-6SU/5S9Y-6SU_decoy_scores.csv |
5SMF-K1S | data/5S/5SMF-K1S/5SMF-K1S_ligand.pdbqt | data/5S/5SMF-K1S/5SMF-K1S_target.pdbqt | data/5S/5SMF-K1S/5SMF-K1S_decoys.pdbqt | data/5S/5SMF-K1S/5SMF-K1S_decoy_scores.csv |
5SII-JPU | data/5S/5SII-JPU/5SII-JPU_ligand.pdbqt | data/5S/5SII-JPU/5SII-JPU_target.pdbqt | data/5S/5SII-JPU/5SII-JPU_decoys.pdbqt | data/5S/5SII-JPU/5SII-JPU_decoy_scores.csv |
5S5F-ACP | data/5S/5S5F-ACP/5S5F-ACP_ligand.pdbqt | data/5S/5S5F-ACP/5S5F-ACP_target.pdbqt | data/5S/5S5F-ACP/5S5F-ACP_decoys.pdbqt | data/5S/5S5F-ACP/5S5F-ACP_decoy_scores.csv |
5SA3-O0M | data/5S/5SA3-O0M/5SA3-O0M_ligand.pdbqt | data/5S/5SA3-O0M/5SA3-O0M_target.pdbqt | data/5S/5SA3-O0M/5SA3-O0M_decoys.pdbqt | data/5S/5SA3-O0M/5SA3-O0M_decoy_scores.csv |
5SB7-GDP | data/5S/5SB7-GDP/5SB7-GDP_ligand.pdbqt | data/5S/5SB7-GDP/5SB7-GDP_target.pdbqt | data/5S/5SB7-GDP/5SB7-GDP_decoys.pdbqt | data/5S/5SB7-GDP/5SB7-GDP_decoy_scores.csv |
5S94-Y2M | data/5S/5S94-Y2M/5S94-Y2M_ligand.pdbqt | data/5S/5S94-Y2M/5S94-Y2M_target.pdbqt | data/5S/5S94-Y2M/5S94-Y2M_decoys.pdbqt | data/5S/5S94-Y2M/5S94-Y2M_decoy_scores.csv |
5SKE-KF3 | data/5S/5SKE-KF3/5SKE-KF3_ligand.pdbqt | data/5S/5SKE-KF3/5SKE-KF3_target.pdbqt | data/5S/5SKE-KF3/5SKE-KF3_decoys.pdbqt | data/5S/5SKE-KF3/5SKE-KF3_decoy_scores.csv |
5S85-LU8 | data/5S/5S85-LU8/5S85-LU8_ligand.pdbqt | data/5S/5S85-LU8/5S85-LU8_target.pdbqt | data/5S/5S85-LU8/5S85-LU8_decoys.pdbqt | data/5S/5S85-LU8/5S85-LU8_decoy_scores.csv |
5S91-Y1S | data/5S/5S91-Y1S/5S91-Y1S_ligand.pdbqt | data/5S/5S91-Y1S/5S91-Y1S_target.pdbqt | data/5S/5S91-Y1S/5S91-Y1S_decoys.pdbqt | data/5S/5S91-Y1S/5S91-Y1S_decoy_scores.csv |
5SCY-HEI | data/5S/5SCY-HEI/5SCY-HEI_ligand.pdbqt | data/5S/5SCY-HEI/5SCY-HEI_target.pdbqt | data/5S/5SCY-HEI/5SCY-HEI_decoys.pdbqt | data/5S/5SCY-HEI/5SCY-HEI_decoy_scores.csv |
5S4Z-GDP | data/5S/5S4Z-GDP/5S4Z-GDP_ligand.pdbqt | data/5S/5S4Z-GDP/5S4Z-GDP_target.pdbqt | data/5S/5S4Z-GDP/5S4Z-GDP_decoys.pdbqt | data/5S/5S4Z-GDP/5S4Z-GDP_decoy_scores.csv |
5S8D-N1E | data/5S/5S8D-N1E/5S8D-N1E_ligand.pdbqt | data/5S/5S8D-N1E/5S8D-N1E_target.pdbqt | data/5S/5S8D-N1E/5S8D-N1E_decoys.pdbqt | data/5S/5S8D-N1E/5S8D-N1E_decoy_scores.csv |
5S57-GTP | data/5S/5S57-GTP/5S57-GTP_ligand.pdbqt | data/5S/5S57-GTP/5S57-GTP_target.pdbqt | data/5S/5S57-GTP/5S57-GTP_decoys.pdbqt | data/5S/5S57-GTP/5S57-GTP_decoy_scores.csv |
5SZY-GDP | data/5S/5SZY-GDP/5SZY-GDP_ligand.pdbqt | data/5S/5SZY-GDP/5SZY-GDP_target.pdbqt | data/5S/5SZY-GDP/5SZY-GDP_decoys.pdbqt | data/5S/5SZY-GDP/5SZY-GDP_decoy_scores.csv |
5SHY-JJR | data/5S/5SHY-JJR/5SHY-JJR_ligand.pdbqt | data/5S/5SHY-JJR/5SHY-JJR_target.pdbqt | data/5S/5SHY-JJR/5SHY-JJR_decoys.pdbqt | data/5S/5SHY-JJR/5SHY-JJR_decoy_scores.csv |
5S3M-S2S | data/5S/5S3M-S2S/5S3M-S2S_ligand.pdbqt | data/5S/5S3M-S2S/5S3M-S2S_target.pdbqt | data/5S/5S3M-S2S/5S3M-S2S_decoys.pdbqt | data/5S/5S3M-S2S/5S3M-S2S_decoy_scores.csv |
5SMI-LQV | data/5S/5SMI-LQV/5SMI-LQV_ligand.pdbqt | data/5S/5SMI-LQV/5SMI-LQV_target.pdbqt | data/5S/5SMI-LQV/5SMI-LQV_decoys.pdbqt | data/5S/5SMI-LQV/5SMI-LQV_decoy_scores.csv |
5SC4-8CN | data/5S/5SC4-8CN/5SC4-8CN_ligand.pdbqt | data/5S/5SC4-8CN/5SC4-8CN_target.pdbqt | data/5S/5SC4-8CN/5SC4-8CN_decoys.pdbqt | data/5S/5SC4-8CN/5SC4-8CN_decoy_scores.csv |
5SFN-ILS | data/5S/5SFN-ILS/5SFN-ILS_ligand.pdbqt | data/5S/5SFN-ILS/5SFN-ILS_target.pdbqt | data/5S/5SFN-ILS/5SFN-ILS_decoys.pdbqt | data/5S/5SFN-ILS/5SFN-ILS_decoy_scores.csv |
5SA9-GWG | data/5S/5SA9-GWG/5SA9-GWG_ligand.pdbqt | data/5S/5SA9-GWG/5SA9-GWG_target.pdbqt | data/5S/5SA9-GWG/5SA9-GWG_decoys.pdbqt | data/5S/5SA9-GWG/5SA9-GWG_decoy_scores.csv |
5S8T-Y0J | data/5S/5S8T-Y0J/5S8T-Y0J_ligand.pdbqt | data/5S/5S8T-Y0J/5S8T-Y0J_target.pdbqt | data/5S/5S8T-Y0J/5S8T-Y0J_decoys.pdbqt | data/5S/5S8T-Y0J/5S8T-Y0J_decoy_scores.csv |
5S2Q-W0A | data/5S/5S2Q-W0A/5S2Q-W0A_ligand.pdbqt | data/5S/5S2Q-W0A/5S2Q-W0A_target.pdbqt | data/5S/5S2Q-W0A/5S2Q-W0A_decoys.pdbqt | data/5S/5S2Q-W0A/5S2Q-W0A_decoy_scores.csv |
5S4U-GTP | data/5S/5S4U-GTP/5S4U-GTP_ligand.pdbqt | data/5S/5S4U-GTP/5S4U-GTP_target.pdbqt | data/5S/5S4U-GTP/5S4U-GTP_decoys.pdbqt | data/5S/5S4U-GTP/5S4U-GTP_decoy_scores.csv |
5S2N-GWY | data/5S/5S2N-GWY/5S2N-GWY_ligand.pdbqt | data/5S/5S2N-GWY/5S2N-GWY_target.pdbqt | data/5S/5S2N-GWY/5S2N-GWY_decoys.pdbqt | data/5S/5S2N-GWY/5S2N-GWY_decoy_scores.csv |
5SFE-WP3 | data/5S/5SFE-WP3/5SFE-WP3_ligand.pdbqt | data/5S/5SFE-WP3/5SFE-WP3_target.pdbqt | data/5S/5SFE-WP3/5SFE-WP3_decoys.pdbqt | data/5S/5SFE-WP3/5SFE-WP3_decoy_scores.csv |
5S7T-LU8 | data/5S/5S7T-LU8/5S7T-LU8_ligand.pdbqt | data/5S/5S7T-LU8/5S7T-LU8_target.pdbqt | data/5S/5S7T-LU8/5S7T-LU8_decoys.pdbqt | data/5S/5S7T-LU8/5S7T-LU8_decoy_scores.csv |
5SU2-W7X | data/5S/5SU2-W7X/5SU2-W7X_ligand.pdbqt | data/5S/5SU2-W7X/5SU2-W7X_target.pdbqt | data/5S/5SU2-W7X/5SU2-W7X_decoys.pdbqt | data/5S/5SU2-W7X/5SU2-W7X_decoy_scores.csv |
5S61-GTP | data/5S/5S61-GTP/5S61-GTP_ligand.pdbqt | data/5S/5S61-GTP/5S61-GTP_target.pdbqt | data/5S/5S61-GTP/5S61-GTP_decoys.pdbqt | data/5S/5S61-GTP/5S61-GTP_decoy_scores.csv |
5SDK-I87 | data/5S/5SDK-I87/5SDK-I87_ligand.pdbqt | data/5S/5SDK-I87/5SDK-I87_target.pdbqt | data/5S/5SDK-I87/5SDK-I87_decoys.pdbqt | data/5S/5SDK-I87/5SDK-I87_decoy_scores.csv |
5SBZ-K0D | data/5S/5SBZ-K0D/5SBZ-K0D_ligand.pdbqt | data/5S/5SBZ-K0D/5SBZ-K0D_target.pdbqt | data/5S/5SBZ-K0D/5SBZ-K0D_decoys.pdbqt | data/5S/5SBZ-K0D/5SBZ-K0D_decoy_scores.csv |
5SBA-GDP | data/5S/5SBA-GDP/5SBA-GDP_ligand.pdbqt | data/5S/5SBA-GDP/5SBA-GDP_target.pdbqt | data/5S/5SBA-GDP/5SBA-GDP_decoys.pdbqt | data/5S/5SBA-GDP/5SBA-GDP_decoy_scores.csv |
5S71-WUV | data/5S/5S71-WUV/5S71-WUV_ligand.pdbqt | data/5S/5S71-WUV/5S71-WUV_target.pdbqt | data/5S/5S71-WUV/5S71-WUV_decoys.pdbqt | data/5S/5S71-WUV/5S71-WUV_decoy_scores.csv |
5S8A-LU8 | data/5S/5S8A-LU8/5S8A-LU8_ligand.pdbqt | data/5S/5S8A-LU8/5S8A-LU8_target.pdbqt | data/5S/5S8A-LU8/5S8A-LU8_decoys.pdbqt | data/5S/5S8A-LU8/5S8A-LU8_decoy_scores.csv |
5SLQ-ELQ | data/5S/5SLQ-ELQ/5SLQ-ELQ_ligand.pdbqt | data/5S/5SLQ-ELQ/5SLQ-ELQ_target.pdbqt | data/5S/5SLQ-ELQ/5SLQ-ELQ_decoys.pdbqt | data/5S/5SLQ-ELQ/5SLQ-ELQ_decoy_scores.csv |
5S5Y-W0A | data/5S/5S5Y-W0A/5S5Y-W0A_ligand.pdbqt | data/5S/5S5Y-W0A/5S5Y-W0A_target.pdbqt | data/5S/5S5Y-W0A/5S5Y-W0A_decoys.pdbqt | data/5S/5S5Y-W0A/5S5Y-W0A_decoy_scores.csv |
5S2Z-T6J | data/5S/5S2Z-T6J/5S2Z-T6J_ligand.pdbqt | data/5S/5S2Z-T6J/5S2Z-T6J_target.pdbqt | data/5S/5S2Z-T6J/5S2Z-T6J_decoys.pdbqt | data/5S/5S2Z-T6J/5S2Z-T6J_decoy_scores.csv |
5ST8-V33 | data/5S/5ST8-V33/5ST8-V33_ligand.pdbqt | data/5S/5ST8-V33/5ST8-V33_target.pdbqt | data/5S/5ST8-V33/5ST8-V33_decoys.pdbqt | data/5S/5ST8-V33/5ST8-V33_decoy_scores.csv |
5SZH-GNP | data/5S/5SZH-GNP/5SZH-GNP_ligand.pdbqt | data/5S/5SZH-GNP/5SZH-GNP_target.pdbqt | data/5S/5SZH-GNP/5SZH-GNP_decoys.pdbqt | data/5S/5SZH-GNP/5SZH-GNP_decoy_scores.csv |
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