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 ⌀ |
|---|---|---|---|---|
5S5D-NZJ | data/5S/5S5D-NZJ/5S5D-NZJ_ligand.pdbqt | data/5S/5S5D-NZJ/5S5D-NZJ_target.pdbqt | data/5S/5S5D-NZJ/5S5D-NZJ_decoys.pdbqt | data/5S/5S5D-NZJ/5S5D-NZJ_decoy_scores.csv |
5S86-LU8 | data/5S/5S86-LU8/5S86-LU8_ligand.pdbqt | data/5S/5S86-LU8/5S86-LU8_target.pdbqt | data/5S/5S86-LU8/5S86-LU8_decoys.pdbqt | data/5S/5S86-LU8/5S86-LU8_decoy_scores.csv |
5S55-GDP | data/5S/5S55-GDP/5S55-GDP_ligand.pdbqt | data/5S/5S55-GDP/5S55-GDP_target.pdbqt | data/5S/5S55-GDP/5S55-GDP_decoys.pdbqt | data/5S/5S55-GDP/5S55-GDP_decoy_scores.csv |
5S5J-WKY | data/5S/5S5J-WKY/5S5J-WKY_ligand.pdbqt | data/5S/5S5J-WKY/5S5J-WKY_target.pdbqt | data/5S/5S5J-WKY/5S5J-WKY_decoys.pdbqt | data/5S/5S5J-WKY/5S5J-WKY_decoy_scores.csv |
5SCK-FBP | data/5S/5SCK-FBP/5SCK-FBP_ligand.pdbqt | data/5S/5SCK-FBP/5SCK-FBP_target.pdbqt | data/5S/5SCK-FBP/5SCK-FBP_decoys.pdbqt | data/5S/5SCK-FBP/5SCK-FBP_decoy_scores.csv |
5S6Y-WUJ | data/5S/5S6Y-WUJ/5S6Y-WUJ_ligand.pdbqt | data/5S/5S6Y-WUJ/5S6Y-WUJ_target.pdbqt | data/5S/5S6Y-WUJ/5S6Y-WUJ_decoys.pdbqt | data/5S/5S6Y-WUJ/5S6Y-WUJ_decoy_scores.csv |
5S9Z-O3J | data/5S/5S9Z-O3J/5S9Z-O3J_ligand.pdbqt | data/5S/5S9Z-O3J/5S9Z-O3J_target.pdbqt | data/5S/5S9Z-O3J/5S9Z-O3J_decoys.pdbqt | data/5S/5S9Z-O3J/5S9Z-O3J_decoy_scores.csv |
5S7M-LU8 | data/5S/5S7M-LU8/5S7M-LU8_ligand.pdbqt | data/5S/5S7M-LU8/5S7M-LU8_target.pdbqt | data/5S/5S7M-LU8/5S7M-LU8_decoys.pdbqt | data/5S/5S7M-LU8/5S7M-LU8_decoy_scores.csv |
5S90-Y1P | data/5S/5S90-Y1P/5S90-Y1P_ligand.pdbqt | data/5S/5S90-Y1P/5S90-Y1P_target.pdbqt | data/5S/5S90-Y1P/5S90-Y1P_decoys.pdbqt | data/5S/5S90-Y1P/5S90-Y1P_decoy_scores.csv |
5SEY-IIR | data/5S/5SEY-IIR/5SEY-IIR_ligand.pdbqt | data/5S/5SEY-IIR/5SEY-IIR_target.pdbqt | data/5S/5SEY-IIR/5SEY-IIR_decoys.pdbqt | data/5S/5SEY-IIR/5SEY-IIR_decoy_scores.csv |
5SH4-J4I | data/5S/5SH4-J4I/5SH4-J4I_ligand.pdbqt | data/5S/5SH4-J4I/5SH4-J4I_target.pdbqt | data/5S/5SH4-J4I/5SH4-J4I_decoys.pdbqt | data/5S/5SH4-J4I/5SH4-J4I_decoy_scores.csv |
5S2Y-W0M | data/5S/5S2Y-W0M/5S2Y-W0M_ligand.pdbqt | data/5S/5S2Y-W0M/5S2Y-W0M_target.pdbqt | data/5S/5S2Y-W0M/5S2Y-W0M_decoys.pdbqt | data/5S/5S2Y-W0M/5S2Y-W0M_decoy_scores.csv |
5SE8-IE1 | data/5S/5SE8-IE1/5SE8-IE1_ligand.pdbqt | data/5S/5SE8-IE1/5SE8-IE1_target.pdbqt | data/5S/5SE8-IE1/5SE8-IE1_decoys.pdbqt | data/5S/5SE8-IE1/5SE8-IE1_decoy_scores.csv |
5SCK-I9N | data/5S/5SCK-I9N/5SCK-I9N_ligand.pdbqt | data/5S/5SCK-I9N/5SCK-I9N_target.pdbqt | data/5S/5SCK-I9N/5SCK-I9N_decoys.pdbqt | data/5S/5SCK-I9N/5SCK-I9N_decoy_scores.csv |
5S76-LU8 | data/5S/5S76-LU8/5S76-LU8_ligand.pdbqt | data/5S/5S76-LU8/5S76-LU8_target.pdbqt | data/5S/5S76-LU8/5S76-LU8_decoys.pdbqt | data/5S/5S76-LU8/5S76-LU8_decoy_scores.csv |
5SKW-LF6 | data/5S/5SKW-LF6/5SKW-LF6_ligand.pdbqt | data/5S/5SKW-LF6/5SKW-LF6_target.pdbqt | data/5S/5SKW-LF6/5SKW-LF6_decoys.pdbqt | data/5S/5SKW-LF6/5SKW-LF6_decoy_scores.csv |
5SFR-IOI | data/5S/5SFR-IOI/5SFR-IOI_ligand.pdbqt | data/5S/5SFR-IOI/5SFR-IOI_target.pdbqt | data/5S/5SFR-IOI/5SFR-IOI_decoys.pdbqt | data/5S/5SFR-IOI/5SFR-IOI_decoy_scores.csv |
5SGX-IZH | data/5S/5SGX-IZH/5SGX-IZH_ligand.pdbqt | data/5S/5SGX-IZH/5SGX-IZH_target.pdbqt | data/5S/5SGX-IZH/5SGX-IZH_decoys.pdbqt | data/5S/5SGX-IZH/5SGX-IZH_decoy_scores.csv |
5SCL-FBP | data/5S/5SCL-FBP/5SCL-FBP_ligand.pdbqt | data/5S/5SCL-FBP/5SCL-FBP_target.pdbqt | data/5S/5SCL-FBP/5SCL-FBP_decoys.pdbqt | data/5S/5SCL-FBP/5SCL-FBP_decoy_scores.csv |
5SJ9-JYL | data/5S/5SJ9-JYL/5SJ9-JYL_ligand.pdbqt | data/5S/5SJ9-JYL/5SJ9-JYL_target.pdbqt | data/5S/5SJ9-JYL/5SJ9-JYL_decoys.pdbqt | data/5S/5SJ9-JYL/5SJ9-JYL_decoy_scores.csv |
5S4Y-GDP | data/5S/5S4Y-GDP/5S4Y-GDP_ligand.pdbqt | data/5S/5S4Y-GDP/5S4Y-GDP_target.pdbqt | data/5S/5S4Y-GDP/5S4Y-GDP_decoys.pdbqt | data/5S/5S4Y-GDP/5S4Y-GDP_decoy_scores.csv |
5SCU-H0I | data/5S/5SCU-H0I/5SCU-H0I_ligand.pdbqt | data/5S/5SCU-H0I/5SCU-H0I_target.pdbqt | data/5S/5SCU-H0I/5SCU-H0I_decoys.pdbqt | data/5S/5SCU-H0I/5SCU-H0I_decoy_scores.csv |
5SLM-WN1 | data/5S/5SLM-WN1/5SLM-WN1_ligand.pdbqt | data/5S/5SLM-WN1/5SLM-WN1_target.pdbqt | data/5S/5SLM-WN1/5SLM-WN1_decoys.pdbqt | data/5S/5SLM-WN1/5SLM-WN1_decoy_scores.csv |
5SA4-K3A | data/5S/5SA4-K3A/5SA4-K3A_ligand.pdbqt | data/5S/5SA4-K3A/5SA4-K3A_target.pdbqt | data/5S/5SA4-K3A/5SA4-K3A_decoys.pdbqt | data/5S/5SA4-K3A/5SA4-K3A_decoy_scores.csv |
5S83-LU8 | data/5S/5S83-LU8/5S83-LU8_ligand.pdbqt | data/5S/5S83-LU8/5S83-LU8_target.pdbqt | null | null |
5SG4-IVJ | data/5S/5SG4-IVJ/5SG4-IVJ_ligand.pdbqt | data/5S/5SG4-IVJ/5SG4-IVJ_target.pdbqt | data/5S/5SG4-IVJ/5SG4-IVJ_decoys.pdbqt | data/5S/5SG4-IVJ/5SG4-IVJ_decoy_scores.csv |
5S4S-ACP | data/5S/5S4S-ACP/5S4S-ACP_ligand.pdbqt | data/5S/5S4S-ACP/5S4S-ACP_target.pdbqt | data/5S/5S4S-ACP/5S4S-ACP_decoys.pdbqt | data/5S/5S4S-ACP/5S4S-ACP_decoy_scores.csv |
5SBD-5KI | data/5S/5SBD-5KI/5SBD-5KI_ligand.pdbqt | data/5S/5SBD-5KI/5SBD-5KI_target.pdbqt | data/5S/5SBD-5KI/5SBD-5KI_decoys.pdbqt | data/5S/5SBD-5KI/5SBD-5KI_decoy_scores.csv |
5SW3-46L | data/5S/5SW3-46L/5SW3-46L_ligand.pdbqt | data/5S/5SW3-46L/5SW3-46L_target.pdbqt | data/5S/5SW3-46L/5SW3-46L_decoys.pdbqt | data/5S/5SW3-46L/5SW3-46L_decoy_scores.csv |
5SJI-K3F | data/5S/5SJI-K3F/5SJI-K3F_ligand.pdbqt | data/5S/5SJI-K3F/5SJI-K3F_target.pdbqt | data/5S/5SJI-K3F/5SJI-K3F_decoys.pdbqt | data/5S/5SJI-K3F/5SJI-K3F_decoy_scores.csv |
5S2B-WSG | data/5S/5S2B-WSG/5S2B-WSG_ligand.pdbqt | data/5S/5S2B-WSG/5S2B-WSG_target.pdbqt | data/5S/5S2B-WSG/5S2B-WSG_decoys.pdbqt | data/5S/5S2B-WSG/5S2B-WSG_decoy_scores.csv |
5S9P-YW4 | data/5S/5S9P-YW4/5S9P-YW4_ligand.pdbqt | data/5S/5S9P-YW4/5S9P-YW4_target.pdbqt | data/5S/5S9P-YW4/5S9P-YW4_decoys.pdbqt | data/5S/5S9P-YW4/5S9P-YW4_decoy_scores.csv |
5SBC-ACP | data/5S/5SBC-ACP/5SBC-ACP_ligand.pdbqt | data/5S/5SBC-ACP/5SBC-ACP_target.pdbqt | data/5S/5SBC-ACP/5SBC-ACP_decoys.pdbqt | data/5S/5SBC-ACP/5SBC-ACP_decoy_scores.csv |
5SAH-ZQJ | data/5S/5SAH-ZQJ/5SAH-ZQJ_ligand.pdbqt | data/5S/5SAH-ZQJ/5SAH-ZQJ_target.pdbqt | data/5S/5SAH-ZQJ/5SAH-ZQJ_decoys.pdbqt | data/5S/5SAH-ZQJ/5SAH-ZQJ_decoy_scores.csv |
5S51-ACP | data/5S/5S51-ACP/5S51-ACP_ligand.pdbqt | data/5S/5S51-ACP/5S51-ACP_target.pdbqt | data/5S/5S51-ACP/5S51-ACP_decoys.pdbqt | data/5S/5S51-ACP/5S51-ACP_decoy_scores.csv |
5S1Y-WQY | data/5S/5S1Y-WQY/5S1Y-WQY_ligand.pdbqt | data/5S/5S1Y-WQY/5S1Y-WQY_target.pdbqt | data/5S/5S1Y-WQY/5S1Y-WQY_decoys.pdbqt | data/5S/5S1Y-WQY/5S1Y-WQY_decoy_scores.csv |
5S3C-W1D | data/5S/5S3C-W1D/5S3C-W1D_ligand.pdbqt | data/5S/5S3C-W1D/5S3C-W1D_target.pdbqt | data/5S/5S3C-W1D/5S3C-W1D_decoys.pdbqt | data/5S/5S3C-W1D/5S3C-W1D_decoy_scores.csv |
5SEG-IFN | data/5S/5SEG-IFN/5SEG-IFN_ligand.pdbqt | data/5S/5SEG-IFN/5SEG-IFN_target.pdbqt | data/5S/5SEG-IFN/5SEG-IFN_decoys.pdbqt | data/5S/5SEG-IFN/5SEG-IFN_decoy_scores.csv |
5SCN-GUU | data/5S/5SCN-GUU/5SCN-GUU_ligand.pdbqt | data/5S/5SCN-GUU/5SCN-GUU_target.pdbqt | data/5S/5SCN-GUU/5SCN-GUU_decoys.pdbqt | data/5S/5SCN-GUU/5SCN-GUU_decoy_scores.csv |
5STJ-W8F | data/5S/5STJ-W8F/5STJ-W8F_ligand.pdbqt | data/5S/5STJ-W8F/5STJ-W8F_target.pdbqt | data/5S/5STJ-W8F/5STJ-W8F_decoys.pdbqt | data/5S/5STJ-W8F/5STJ-W8F_decoy_scores.csv |
5SLO-JJM | data/5S/5SLO-JJM/5SLO-JJM_ligand.pdbqt | data/5S/5SLO-JJM/5SLO-JJM_target.pdbqt | data/5S/5SLO-JJM/5SLO-JJM_decoys.pdbqt | data/5S/5SLO-JJM/5SLO-JJM_decoy_scores.csv |
5SB8-GTP | data/5S/5SB8-GTP/5SB8-GTP_ligand.pdbqt | data/5S/5SB8-GTP/5SB8-GTP_target.pdbqt | data/5S/5SB8-GTP/5SB8-GTP_decoys.pdbqt | data/5S/5SB8-GTP/5SB8-GTP_decoy_scores.csv |
5S5S-VWA | data/5S/5S5S-VWA/5S5S-VWA_ligand.pdbqt | data/5S/5S5S-VWA/5S5S-VWA_target.pdbqt | data/5S/5S5S-VWA/5S5S-VWA_decoys.pdbqt | data/5S/5S5S-VWA/5S5S-VWA_decoy_scores.csv |
5SEK-IFY | data/5S/5SEK-IFY/5SEK-IFY_ligand.pdbqt | data/5S/5SEK-IFY/5SEK-IFY_target.pdbqt | data/5S/5SEK-IFY/5SEK-IFY_decoys.pdbqt | data/5S/5SEK-IFY/5SEK-IFY_decoy_scores.csv |
5S7Z-LU8 | data/5S/5S7Z-LU8/5S7Z-LU8_ligand.pdbqt | data/5S/5S7Z-LU8/5S7Z-LU8_target.pdbqt | data/5S/5S7Z-LU8/5S7Z-LU8_decoys.pdbqt | data/5S/5S7Z-LU8/5S7Z-LU8_decoy_scores.csv |
5SCJ-FBP | data/5S/5SCJ-FBP/5SCJ-FBP_ligand.pdbqt | data/5S/5SCJ-FBP/5SCJ-FBP_target.pdbqt | data/5S/5SCJ-FBP/5SCJ-FBP_decoys.pdbqt | data/5S/5SCJ-FBP/5SCJ-FBP_decoy_scores.csv |
5SVV-FMN | data/5S/5SVV-FMN/5SVV-FMN_ligand.pdbqt | data/5S/5SVV-FMN/5SVV-FMN_target.pdbqt | data/5S/5SVV-FMN/5SVV-FMN_decoys.pdbqt | data/5S/5SVV-FMN/5SVV-FMN_decoy_scores.csv |
5S66-LVV | data/5S/5S66-LVV/5S66-LVV_ligand.pdbqt | data/5S/5S66-LVV/5S66-LVV_target.pdbqt | data/5S/5S66-LVV/5S66-LVV_decoys.pdbqt | data/5S/5S66-LVV/5S66-LVV_decoy_scores.csv |
5SI1-JKO | data/5S/5SI1-JKO/5SI1-JKO_ligand.pdbqt | data/5S/5SI1-JKO/5SI1-JKO_target.pdbqt | data/5S/5SI1-JKO/5SI1-JKO_decoys.pdbqt | data/5S/5SI1-JKO/5SI1-JKO_decoy_scores.csv |
5SBD-GDP | data/5S/5SBD-GDP/5SBD-GDP_ligand.pdbqt | data/5S/5SBD-GDP/5SBD-GDP_target.pdbqt | data/5S/5SBD-GDP/5SBD-GDP_decoys.pdbqt | data/5S/5SBD-GDP/5SBD-GDP_decoy_scores.csv |
5SG2-GIQ | data/5S/5SG2-GIQ/5SG2-GIQ_ligand.pdbqt | data/5S/5SG2-GIQ/5SG2-GIQ_target.pdbqt | data/5S/5SG2-GIQ/5SG2-GIQ_decoys.pdbqt | data/5S/5SG2-GIQ/5SG2-GIQ_decoy_scores.csv |
5S8Y-Y1J | data/5S/5S8Y-Y1J/5S8Y-Y1J_ligand.pdbqt | data/5S/5S8Y-Y1J/5S8Y-Y1J_target.pdbqt | data/5S/5S8Y-Y1J/5S8Y-Y1J_decoys.pdbqt | data/5S/5S8Y-Y1J/5S8Y-Y1J_decoy_scores.csv |
5SA8-JOV | data/5S/5SA8-JOV/5SA8-JOV_ligand.pdbqt | data/5S/5SA8-JOV/5SA8-JOV_target.pdbqt | data/5S/5SA8-JOV/5SA8-JOV_decoys.pdbqt | data/5S/5SA8-JOV/5SA8-JOV_decoy_scores.csv |
5SU7-V3R | data/5S/5SU7-V3R/5SU7-V3R_ligand.pdbqt | data/5S/5SU7-V3R/5SU7-V3R_target.pdbqt | data/5S/5SU7-V3R/5SU7-V3R_decoys.pdbqt | data/5S/5SU7-V3R/5SU7-V3R_decoy_scores.csv |
5S4I-W3Y | data/5S/5S4I-W3Y/5S4I-W3Y_ligand.pdbqt | data/5S/5S4I-W3Y/5S4I-W3Y_target.pdbqt | data/5S/5S4I-W3Y/5S4I-W3Y_decoys.pdbqt | data/5S/5S4I-W3Y/5S4I-W3Y_decoy_scores.csv |
5STQ-VP0 | data/5S/5STQ-VP0/5STQ-VP0_ligand.pdbqt | data/5S/5STQ-VP0/5STQ-VP0_target.pdbqt | data/5S/5STQ-VP0/5STQ-VP0_decoys.pdbqt | data/5S/5STQ-VP0/5STQ-VP0_decoy_scores.csv |
5SYN-71T | data/5S/5SYN-71T/5SYN-71T_ligand.pdbqt | data/5S/5SYN-71T/5SYN-71T_target.pdbqt | data/5S/5SYN-71T/5SYN-71T_decoys.pdbqt | data/5S/5SYN-71T/5SYN-71T_decoy_scores.csv |
5SBA-ACP | data/5S/5SBA-ACP/5SBA-ACP_ligand.pdbqt | data/5S/5SBA-ACP/5SBA-ACP_target.pdbqt | data/5S/5SBA-ACP/5SBA-ACP_decoys.pdbqt | data/5S/5SBA-ACP/5SBA-ACP_decoy_scores.csv |
5SH0-IZT | data/5S/5SH0-IZT/5SH0-IZT_ligand.pdbqt | data/5S/5SH0-IZT/5SH0-IZT_target.pdbqt | data/5S/5SH0-IZT/5SH0-IZT_decoys.pdbqt | data/5S/5SH0-IZT/5SH0-IZT_decoy_scores.csv |
5S5I-GTP | data/5S/5S5I-GTP/5S5I-GTP_ligand.pdbqt | data/5S/5S5I-GTP/5S5I-GTP_target.pdbqt | data/5S/5S5I-GTP/5S5I-GTP_decoys.pdbqt | data/5S/5S5I-GTP/5S5I-GTP_decoy_scores.csv |
5S5K-S6V | data/5S/5S5K-S6V/5S5K-S6V_ligand.pdbqt | data/5S/5S5K-S6V/5S5K-S6V_target.pdbqt | data/5S/5S5K-S6V/5S5K-S6V_decoys.pdbqt | data/5S/5S5K-S6V/5S5K-S6V_decoy_scores.csv |
5S9C-Y0D | data/5S/5S9C-Y0D/5S9C-Y0D_ligand.pdbqt | data/5S/5S9C-Y0D/5S9C-Y0D_target.pdbqt | data/5S/5S9C-Y0D/5S9C-Y0D_decoys.pdbqt | data/5S/5S9C-Y0D/5S9C-Y0D_decoy_scores.csv |
5S5B-GDP | data/5S/5S5B-GDP/5S5B-GDP_ligand.pdbqt | data/5S/5S5B-GDP/5S5B-GDP_target.pdbqt | data/5S/5S5B-GDP/5S5B-GDP_decoys.pdbqt | data/5S/5S5B-GDP/5S5B-GDP_decoy_scores.csv |
5S5D-GDP | data/5S/5S5D-GDP/5S5D-GDP_ligand.pdbqt | data/5S/5S5D-GDP/5S5D-GDP_target.pdbqt | data/5S/5S5D-GDP/5S5D-GDP_decoys.pdbqt | data/5S/5S5D-GDP/5S5D-GDP_decoy_scores.csv |
5S5I-ACP | data/5S/5S5I-ACP/5S5I-ACP_ligand.pdbqt | data/5S/5S5I-ACP/5S5I-ACP_target.pdbqt | data/5S/5S5I-ACP/5S5I-ACP_decoys.pdbqt | data/5S/5S5I-ACP/5S5I-ACP_decoy_scores.csv |
5SID-JO6 | data/5S/5SID-JO6/5SID-JO6_ligand.pdbqt | data/5S/5SID-JO6/5SID-JO6_target.pdbqt | data/5S/5SID-JO6/5SID-JO6_decoys.pdbqt | data/5S/5SID-JO6/5SID-JO6_decoy_scores.csv |
5SB4-GTP | data/5S/5SB4-GTP/5SB4-GTP_ligand.pdbqt | data/5S/5SB4-GTP/5SB4-GTP_target.pdbqt | data/5S/5SB4-GTP/5SB4-GTP_decoys.pdbqt | data/5S/5SB4-GTP/5SB4-GTP_decoy_scores.csv |
5SAI-ZQM | data/5S/5SAI-ZQM/5SAI-ZQM_ligand.pdbqt | data/5S/5SAI-ZQM/5SAI-ZQM_target.pdbqt | data/5S/5SAI-ZQM/5SAI-ZQM_decoys.pdbqt | data/5S/5SAI-ZQM/5SAI-ZQM_decoy_scores.csv |
5S1W-WQV | data/5S/5S1W-WQV/5S1W-WQV_ligand.pdbqt | data/5S/5S1W-WQV/5S1W-WQV_target.pdbqt | data/5S/5S1W-WQV/5S1W-WQV_decoys.pdbqt | data/5S/5S1W-WQV/5S1W-WQV_decoy_scores.csv |
5S26-L46 | data/5S/5S26-L46/5S26-L46_ligand.pdbqt | data/5S/5S26-L46/5S26-L46_target.pdbqt | data/5S/5S26-L46/5S26-L46_decoys.pdbqt | data/5S/5S26-L46/5S26-L46_decoy_scores.csv |
5S7U-LU8 | data/5S/5S7U-LU8/5S7U-LU8_ligand.pdbqt | data/5S/5S7U-LU8/5S7U-LU8_target.pdbqt | data/5S/5S7U-LU8/5S7U-LU8_decoys.pdbqt | data/5S/5S7U-LU8/5S7U-LU8_decoy_scores.csv |
5SDU-I9Z | data/5S/5SDU-I9Z/5SDU-I9Z_ligand.pdbqt | data/5S/5SDU-I9Z/5SDU-I9Z_target.pdbqt | data/5S/5SDU-I9Z/5SDU-I9Z_decoys.pdbqt | data/5S/5SDU-I9Z/5SDU-I9Z_decoy_scores.csv |
5SEN-IG9 | data/5S/5SEN-IG9/5SEN-IG9_ligand.pdbqt | data/5S/5SEN-IG9/5SEN-IG9_target.pdbqt | data/5S/5SEN-IG9/5SEN-IG9_decoys.pdbqt | data/5S/5SEN-IG9/5SEN-IG9_decoy_scores.csv |
5SB1-1JI | data/5S/5SB1-1JI/5SB1-1JI_ligand.pdbqt | data/5S/5SB1-1JI/5SB1-1JI_target.pdbqt | data/5S/5SB1-1JI/5SB1-1JI_decoys.pdbqt | data/5S/5SB1-1JI/5SB1-1JI_decoy_scores.csv |
5SI6-JME | data/5S/5SI6-JME/5SI6-JME_ligand.pdbqt | data/5S/5SI6-JME/5SI6-JME_target.pdbqt | data/5S/5SI6-JME/5SI6-JME_decoys.pdbqt | data/5S/5SI6-JME/5SI6-JME_decoy_scores.csv |
5SB4-4B6 | data/5S/5SB4-4B6/5SB4-4B6_ligand.pdbqt | data/5S/5SB4-4B6/5SB4-4B6_target.pdbqt | data/5S/5SB4-4B6/5SB4-4B6_decoys.pdbqt | data/5S/5SB4-4B6/5SB4-4B6_decoy_scores.csv |
5S8S-Y0G | data/5S/5S8S-Y0G/5S8S-Y0G_ligand.pdbqt | data/5S/5S8S-Y0G/5S8S-Y0G_target.pdbqt | data/5S/5S8S-Y0G/5S8S-Y0G_decoys.pdbqt | data/5S/5S8S-Y0G/5S8S-Y0G_decoy_scores.csv |
5SFV-IQ9 | data/5S/5SFV-IQ9/5SFV-IQ9_ligand.pdbqt | data/5S/5SFV-IQ9/5SFV-IQ9_target.pdbqt | data/5S/5SFV-IQ9/5SFV-IQ9_decoys.pdbqt | data/5S/5SFV-IQ9/5SFV-IQ9_decoy_scores.csv |
5SXS-NIZ | data/5S/5SXS-NIZ/5SXS-NIZ_ligand.pdbqt | data/5S/5SXS-NIZ/5SXS-NIZ_target.pdbqt | data/5S/5SXS-NIZ/5SXS-NIZ_decoys.pdbqt | data/5S/5SXS-NIZ/5SXS-NIZ_decoy_scores.csv |
5S29-WRY | data/5S/5S29-WRY/5S29-WRY_ligand.pdbqt | data/5S/5S29-WRY/5S29-WRY_target.pdbqt | data/5S/5S29-WRY/5S29-WRY_decoys.pdbqt | data/5S/5S29-WRY/5S29-WRY_decoy_scores.csv |
5SHO-JIC | data/5S/5SHO-JIC/5SHO-JIC_ligand.pdbqt | data/5S/5SHO-JIC/5SHO-JIC_target.pdbqt | data/5S/5SHO-JIC/5SHO-JIC_decoys.pdbqt | data/5S/5SHO-JIC/5SHO-JIC_decoy_scores.csv |
5S61-AYV | data/5S/5S61-AYV/5S61-AYV_ligand.pdbqt | data/5S/5S61-AYV/5S61-AYV_target.pdbqt | data/5S/5S61-AYV/5S61-AYV_decoys.pdbqt | data/5S/5S61-AYV/5S61-AYV_decoy_scores.csv |
5SE9-ID9 | data/5S/5SE9-ID9/5SE9-ID9_ligand.pdbqt | data/5S/5SE9-ID9/5SE9-ID9_target.pdbqt | data/5S/5SE9-ID9/5SE9-ID9_decoys.pdbqt | data/5S/5SE9-ID9/5SE9-ID9_decoy_scores.csv |
5SGP-IYD | data/5S/5SGP-IYD/5SGP-IYD_ligand.pdbqt | data/5S/5SGP-IYD/5SGP-IYD_target.pdbqt | data/5S/5SGP-IYD/5SGP-IYD_decoys.pdbqt | data/5S/5SGP-IYD/5SGP-IYD_decoy_scores.csv |
5STW-V8L | data/5S/5STW-V8L/5STW-V8L_ligand.pdbqt | data/5S/5STW-V8L/5STW-V8L_target.pdbqt | data/5S/5STW-V8L/5STW-V8L_decoys.pdbqt | data/5S/5STW-V8L/5STW-V8L_decoy_scores.csv |
5SD8-HJI | data/5S/5SD8-HJI/5SD8-HJI_ligand.pdbqt | data/5S/5SD8-HJI/5SD8-HJI_target.pdbqt | data/5S/5SD8-HJI/5SD8-HJI_decoys.pdbqt | data/5S/5SD8-HJI/5SD8-HJI_decoy_scores.csv |
5SB5-4CJ | data/5S/5SB5-4CJ/5SB5-4CJ_ligand.pdbqt | data/5S/5SB5-4CJ/5SB5-4CJ_target.pdbqt | data/5S/5SB5-4CJ/5SB5-4CJ_decoys.pdbqt | data/5S/5SB5-4CJ/5SB5-4CJ_decoy_scores.csv |
5S7B-LU8 | data/5S/5S7B-LU8/5S7B-LU8_ligand.pdbqt | data/5S/5S7B-LU8/5S7B-LU8_target.pdbqt | data/5S/5S7B-LU8/5S7B-LU8_decoys.pdbqt | data/5S/5S7B-LU8/5S7B-LU8_decoy_scores.csv |
5STS-V0O | data/5S/5STS-V0O/5STS-V0O_ligand.pdbqt | data/5S/5STS-V0O/5STS-V0O_target.pdbqt | data/5S/5STS-V0O/5STS-V0O_decoys.pdbqt | data/5S/5STS-V0O/5STS-V0O_decoy_scores.csv |
5S8B-LU8 | data/5S/5S8B-LU8/5S8B-LU8_ligand.pdbqt | data/5S/5S8B-LU8/5S8B-LU8_target.pdbqt | data/5S/5S8B-LU8/5S8B-LU8_decoys.pdbqt | data/5S/5S8B-LU8/5S8B-LU8_decoy_scores.csv |
5SIS-JSM | data/5S/5SIS-JSM/5SIS-JSM_ligand.pdbqt | data/5S/5SIS-JSM/5SIS-JSM_target.pdbqt | data/5S/5SIS-JSM/5SIS-JSM_decoys.pdbqt | data/5S/5SIS-JSM/5SIS-JSM_decoy_scores.csv |
5STD-UNN | data/5S/5STD-UNN/5STD-UNN_ligand.pdbqt | data/5S/5STD-UNN/5STD-UNN_target.pdbqt | data/5S/5STD-UNN/5STD-UNN_decoys.pdbqt | data/5S/5STD-UNN/5STD-UNN_decoy_scores.csv |
5SGI-IX9 | data/5S/5SGI-IX9/5SGI-IX9_ligand.pdbqt | data/5S/5SGI-IX9/5SGI-IX9_target.pdbqt | data/5S/5SGI-IX9/5SGI-IX9_decoys.pdbqt | data/5S/5SGI-IX9/5SGI-IX9_decoy_scores.csv |
5S2G-JHJ | data/5S/5S2G-JHJ/5S2G-JHJ_ligand.pdbqt | data/5S/5S2G-JHJ/5S2G-JHJ_target.pdbqt | data/5S/5S2G-JHJ/5S2G-JHJ_decoys.pdbqt | data/5S/5S2G-JHJ/5S2G-JHJ_decoy_scores.csv |
5S4G-W3S | data/5S/5S4G-W3S/5S4G-W3S_ligand.pdbqt | data/5S/5S4G-W3S/5S4G-W3S_target.pdbqt | data/5S/5S4G-W3S/5S4G-W3S_decoys.pdbqt | data/5S/5S4G-W3S/5S4G-W3S_decoy_scores.csv |
5STK-W93 | data/5S/5STK-W93/5STK-W93_ligand.pdbqt | data/5S/5STK-W93/5STK-W93_target.pdbqt | data/5S/5STK-W93/5STK-W93_decoys.pdbqt | data/5S/5STK-W93/5STK-W93_decoy_scores.csv |
5S7S-LU8 | data/5S/5S7S-LU8/5S7S-LU8_ligand.pdbqt | data/5S/5S7S-LU8/5S7S-LU8_target.pdbqt | data/5S/5S7S-LU8/5S7S-LU8_decoys.pdbqt | data/5S/5S7S-LU8/5S7S-LU8_decoy_scores.csv |
5SZ7-72H | data/5S/5SZ7-72H/5SZ7-72H_ligand.pdbqt | data/5S/5SZ7-72H/5SZ7-72H_target.pdbqt | data/5S/5SZ7-72H/5SZ7-72H_decoys.pdbqt | data/5S/5SZ7-72H/5SZ7-72H_decoy_scores.csv |
5SGH-IX5 | data/5S/5SGH-IX5/5SGH-IX5_ligand.pdbqt | data/5S/5SGH-IX5/5SGH-IX5_target.pdbqt | data/5S/5SGH-IX5/5SGH-IX5_decoys.pdbqt | data/5S/5SGH-IX5/5SGH-IX5_decoy_scores.csv |
5S1M-DE5 | data/5S/5S1M-DE5/5S1M-DE5_ligand.pdbqt | data/5S/5S1M-DE5/5S1M-DE5_target.pdbqt | data/5S/5S1M-DE5/5S1M-DE5_decoys.pdbqt | data/5S/5S1M-DE5/5S1M-DE5_decoy_scores.csv |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.