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 ⌀ |
|---|---|---|---|---|
2R2H-KO2 | data/2R/2R2H-KO2/2R2H-KO2_ligand.pdbqt | data/2R/2R2H-KO2/2R2H-KO2_target.pdbqt | data/2R/2R2H-KO2/2R2H-KO2_decoys.pdbqt | data/2R/2R2H-KO2/2R2H-KO2_decoy_scores.csv |
2R6V-FMN | data/2R/2R6V-FMN/2R6V-FMN_ligand.pdbqt | data/2R/2R6V-FMN/2R6V-FMN_target.pdbqt | data/2R/2R6V-FMN/2R6V-FMN_decoys.pdbqt | data/2R/2R6V-FMN/2R6V-FMN_decoy_scores.csv |
2R6N-CKE | data/2R/2R6N-CKE/2R6N-CKE_ligand.pdbqt | data/2R/2R6N-CKE/2R6N-CKE_target.pdbqt | data/2R/2R6N-CKE/2R6N-CKE_decoys.pdbqt | data/2R/2R6N-CKE/2R6N-CKE_decoy_scores.csv |
2R86-ATP | data/2R/2R86-ATP/2R86-ATP_ligand.pdbqt | data/2R/2R86-ATP/2R86-ATP_target.pdbqt | data/2R/2R86-ATP/2R86-ATP_decoys.pdbqt | data/2R/2R86-ATP/2R86-ATP_decoy_scores.csv |
2RG6-287 | data/2R/2RG6-287/2RG6-287_ligand.pdbqt | data/2R/2RG6-287/2RG6-287_target.pdbqt | data/2R/2RG6-287/2RG6-287_decoys.pdbqt | data/2R/2RG6-287/2RG6-287_decoy_scores.csv |
2RTG-BTN | data/2R/2RTG-BTN/2RTG-BTN_ligand.pdbqt | data/2R/2RTG-BTN/2RTG-BTN_target.pdbqt | data/2R/2RTG-BTN/2RTG-BTN_decoys.pdbqt | data/2R/2RTG-BTN/2RTG-BTN_decoy_scores.csv |
2R3Q-5SC | data/2R/2R3Q-5SC/2R3Q-5SC_ligand.pdbqt | data/2R/2R3Q-5SC/2R3Q-5SC_target.pdbqt | data/2R/2R3Q-5SC/2R3Q-5SC_decoys.pdbqt | data/2R/2R3Q-5SC/2R3Q-5SC_decoy_scores.csv |
2R6Y-LLC | data/2R/2R6Y-LLC/2R6Y-LLC_ligand.pdbqt | data/2R/2R6Y-LLC/2R6Y-LLC_target.pdbqt | data/2R/2R6Y-LLC/2R6Y-LLC_decoys.pdbqt | data/2R/2R6Y-LLC/2R6Y-LLC_decoy_scores.csv |
2RFN-AM7 | data/2R/2RFN-AM7/2RFN-AM7_ligand.pdbqt | data/2R/2RFN-AM7/2RFN-AM7_target.pdbqt | data/2R/2RFN-AM7/2RFN-AM7_decoys.pdbqt | data/2R/2RFN-AM7/2RFN-AM7_decoy_scores.csv |
2R8Q-IBM | data/2R/2R8Q-IBM/2R8Q-IBM_ligand.pdbqt | data/2R/2R8Q-IBM/2R8Q-IBM_target.pdbqt | data/2R/2R8Q-IBM/2R8Q-IBM_decoys.pdbqt | data/2R/2R8Q-IBM/2R8Q-IBM_decoy_scores.csv |
2R42-FPS | data/2R/2R42-FPS/2R42-FPS_ligand.pdbqt | data/2R/2R42-FPS/2R42-FPS_target.pdbqt | data/2R/2R42-FPS/2R42-FPS_decoys.pdbqt | data/2R/2R42-FPS/2R42-FPS_decoy_scores.csv |
2RTD-BTN | data/2R/2RTD-BTN/2RTD-BTN_ligand.pdbqt | data/2R/2RTD-BTN/2RTD-BTN_target.pdbqt | data/2R/2RTD-BTN/2RTD-BTN_decoys.pdbqt | data/2R/2RTD-BTN/2RTD-BTN_decoy_scores.csv |
2RAY-258 | data/2R/2RAY-258/2RAY-258_ligand.pdbqt | data/2R/2RAY-258/2RAY-258_target.pdbqt | data/2R/2RAY-258/2RAY-258_decoys.pdbqt | data/2R/2RAY-258/2RAY-258_decoy_scores.csv |
2R4J-13P | data/2R/2R4J-13P/2R4J-13P_ligand.pdbqt | data/2R/2R4J-13P/2R4J-13P_target.pdbqt | data/2R/2R4J-13P/2R4J-13P_decoys.pdbqt | data/2R/2R4J-13P/2R4J-13P_decoy_scores.csv |
2R85-AMP | data/2R/2R85-AMP/2R85-AMP_ligand.pdbqt | data/2R/2R85-AMP/2R85-AMP_target.pdbqt | data/2R/2R85-AMP/2R85-AMP_decoys.pdbqt | data/2R/2R85-AMP/2R85-AMP_decoy_scores.csv |
2RFQ-1PS | data/2R/2RFQ-1PS/2RFQ-1PS_ligand.pdbqt | data/2R/2RFQ-1PS/2RFQ-1PS_target.pdbqt | data/2R/2RFQ-1PS/2RFQ-1PS_decoys.pdbqt | data/2R/2RFQ-1PS/2RFQ-1PS_decoy_scores.csv |
2RB1-261 | data/2R/2RB1-261/2RB1-261_ligand.pdbqt | data/2R/2RB1-261/2RB1-261_target.pdbqt | data/2R/2RB1-261/2RB1-261_decoys.pdbqt | data/2R/2RB1-261/2RB1-261_decoy_scores.csv |
2R9M-Y11 | data/2R/2R9M-Y11/2R9M-Y11_ligand.pdbqt | data/2R/2R9M-Y11/2R9M-Y11_target.pdbqt | data/2R/2R9M-Y11/2R9M-Y11_decoys.pdbqt | data/2R/2R9M-Y11/2R9M-Y11_decoy_scores.csv |
2RD6-78P | data/2R/2RD6-78P/2RD6-78P_ligand.pdbqt | data/2R/2RD6-78P/2RD6-78P_target.pdbqt | data/2R/2RD6-78P/2RD6-78P_decoys.pdbqt | data/2R/2RD6-78P/2RD6-78P_decoy_scores.csv |
2ROY-P28 | data/2R/2ROY-P28/2ROY-P28_ligand.pdbqt | data/2R/2ROY-P28/2ROY-P28_target.pdbqt | data/2R/2ROY-P28/2ROY-P28_decoys.pdbqt | data/2R/2ROY-P28/2ROY-P28_decoy_scores.csv |
2RDB-P6G | data/2R/2RDB-P6G/2RDB-P6G_ligand.pdbqt | data/2R/2RDB-P6G/2RDB-P6G_target.pdbqt | data/2R/2RDB-P6G/2RDB-P6G_decoys.pdbqt | data/2R/2RDB-P6G/2RDB-P6G_decoy_scores.csv |
2RBQ-263 | data/2R/2RBQ-263/2RBQ-263_ligand.pdbqt | data/2R/2RBQ-263/2RBQ-263_target.pdbqt | data/2R/2RBQ-263/2RBQ-263_decoys.pdbqt | data/2R/2RBQ-263/2RBQ-263_decoy_scores.csv |
2R4U-250 | data/2R/2R4U-250/2R4U-250_ligand.pdbqt | data/2R/2R4U-250/2R4U-250_target.pdbqt | data/2R/2R4U-250/2R4U-250_decoys.pdbqt | data/2R/2R4U-250/2R4U-250_decoy_scores.csv |
2RDT-2RD | data/2R/2RDT-2RD/2RDT-2RD_ligand.pdbqt | data/2R/2RDT-2RD/2RDT-2RD_target.pdbqt | data/2R/2RDT-2RD/2RDT-2RD_decoys.pdbqt | data/2R/2RDT-2RD/2RDT-2RD_decoy_scores.csv |
2R2G-EMF | data/2R/2R2G-EMF/2R2G-EMF_ligand.pdbqt | data/2R/2R2G-EMF/2R2G-EMF_target.pdbqt | data/2R/2R2G-EMF/2R2G-EMF_decoys.pdbqt | data/2R/2R2G-EMF/2R2G-EMF_decoy_scores.csv |
2R7K-ACP | data/2R/2R7K-ACP/2R7K-ACP_ligand.pdbqt | data/2R/2R7K-ACP/2R7K-ACP_target.pdbqt | data/2R/2R7K-ACP/2R7K-ACP_decoys.pdbqt | data/2R/2R7K-ACP/2R7K-ACP_decoy_scores.csv |
2RJS-296 | data/2R/2RJS-296/2RJS-296_ligand.pdbqt | data/2R/2RJS-296/2RJS-296_target.pdbqt | data/2R/2RJS-296/2RJS-296_decoys.pdbqt | data/2R/2RJS-296/2RJS-296_decoy_scores.csv |
2R0U-M54 | data/2R/2R0U-M54/2R0U-M54_ligand.pdbqt | data/2R/2R0U-M54/2R0U-M54_target.pdbqt | data/2R/2R0U-M54/2R0U-M54_decoys.pdbqt | data/2R/2R0U-M54/2R0U-M54_decoy_scores.csv |
2R9F-K2Z | data/2R/2R9F-K2Z/2R9F-K2Z_ligand.pdbqt | data/2R/2R9F-K2Z/2R9F-K2Z_target.pdbqt | data/2R/2R9F-K2Z/2R9F-K2Z_decoys.pdbqt | data/2R/2R9F-K2Z/2R9F-K2Z_decoy_scores.csv |
2RGB-GNP | data/2R/2RGB-GNP/2RGB-GNP_ligand.pdbqt | data/2R/2RGB-GNP/2RGB-GNP_target.pdbqt | data/2R/2RGB-GNP/2RGB-GNP_decoys.pdbqt | data/2R/2RGB-GNP/2RGB-GNP_decoy_scores.csv |
2RJ4-AD7 | data/2R/2RJ4-AD7/2RJ4-AD7_ligand.pdbqt | data/2R/2RJ4-AD7/2RJ4-AD7_target.pdbqt | data/2R/2RJ4-AD7/2RJ4-AD7_decoys.pdbqt | data/2R/2RJ4-AD7/2RJ4-AD7_decoy_scores.csv |
2R4T-250 | data/2R/2R4T-250/2R4T-250_ligand.pdbqt | data/2R/2R4T-250/2R4T-250_target.pdbqt | data/2R/2R4T-250/2R4T-250_decoys.pdbqt | data/2R/2R4T-250/2R4T-250_decoy_scores.csv |
2R24-LDT | data/2R/2R24-LDT/2R24-LDT_ligand.pdbqt | data/2R/2R24-LDT/2R24-LDT_target.pdbqt | null | null |
2R3H-SCE | data/2R/2R3H-SCE/2R3H-SCE_ligand.pdbqt | data/2R/2R3H-SCE/2R3H-SCE_target.pdbqt | data/2R/2R3H-SCE/2R3H-SCE_decoys.pdbqt | data/2R/2R3H-SCE/2R3H-SCE_decoy_scores.csv |
2REX-GNP | data/2R/2REX-GNP/2REX-GNP_ligand.pdbqt | data/2R/2REX-GNP/2REX-GNP_target.pdbqt | data/2R/2REX-GNP/2REX-GNP_decoys.pdbqt | data/2R/2REX-GNP/2REX-GNP_decoy_scores.csv |
2R40-FLC | data/2R/2R40-FLC/2R40-FLC_ligand.pdbqt | data/2R/2R40-FLC/2R40-FLC_target.pdbqt | data/2R/2R40-FLC/2R40-FLC_decoys.pdbqt | data/2R/2R40-FLC/2R40-FLC_decoy_scores.csv |
2RTP-IMI | data/2R/2RTP-IMI/2RTP-IMI_ligand.pdbqt | data/2R/2RTP-IMI/2RTP-IMI_target.pdbqt | data/2R/2RTP-IMI/2RTP-IMI_decoys.pdbqt | data/2R/2RTP-IMI/2RTP-IMI_decoy_scores.csv |
2RG5-279 | data/2R/2RG5-279/2RG5-279_ligand.pdbqt | data/2R/2RG5-279/2RG5-279_target.pdbqt | data/2R/2RG5-279/2RG5-279_decoys.pdbqt | data/2R/2RG5-279/2RG5-279_decoy_scores.csv |
2RGP-HYZ | data/2R/2RGP-HYZ/2RGP-HYZ_ligand.pdbqt | data/2R/2RGP-HYZ/2RGP-HYZ_target.pdbqt | data/2R/2RGP-HYZ/2RGP-HYZ_decoys.pdbqt | data/2R/2RGP-HYZ/2RGP-HYZ_decoy_scores.csv |
2RKG-AB1 | data/2R/2RKG-AB1/2RKG-AB1_ligand.pdbqt | data/2R/2RKG-AB1/2RKG-AB1_target.pdbqt | data/2R/2RKG-AB1/2RKG-AB1_decoys.pdbqt | data/2R/2RKG-AB1/2RKG-AB1_decoy_scores.csv |
2R45-T3A | data/2R/2R45-T3A/2R45-T3A_ligand.pdbqt | data/2R/2R45-T3A/2R45-T3A_target.pdbqt | data/2R/2R45-T3A/2R45-T3A_decoys.pdbqt | data/2R/2R45-T3A/2R45-T3A_decoy_scores.csv |
2R3O-2SC | data/2R/2R3O-2SC/2R3O-2SC_ligand.pdbqt | data/2R/2R3O-2SC/2R3O-2SC_target.pdbqt | data/2R/2R3O-2SC/2R3O-2SC_decoys.pdbqt | data/2R/2R3O-2SC/2R3O-2SC_decoy_scores.csv |
2RKV-ZBA | data/2R/2RKV-ZBA/2RKV-ZBA_ligand.pdbqt | data/2R/2RKV-ZBA/2RKV-ZBA_target.pdbqt | data/2R/2RKV-ZBA/2RKV-ZBA_decoys.pdbqt | data/2R/2RKV-ZBA/2RKV-ZBA_decoy_scores.csv |
2RHO-GDP | data/2R/2RHO-GDP/2RHO-GDP_ligand.pdbqt | data/2R/2RHO-GDP/2RHO-GDP_target.pdbqt | data/2R/2RHO-GDP/2RHO-GDP_decoys.pdbqt | data/2R/2RHO-GDP/2RHO-GDP_decoy_scores.csv |
2RHC-EMO | data/2R/2RHC-EMO/2RHC-EMO_ligand.pdbqt | data/2R/2RHC-EMO/2RHC-EMO_target.pdbqt | data/2R/2RHC-EMO/2RHC-EMO_decoys.pdbqt | data/2R/2RHC-EMO/2RHC-EMO_decoy_scores.csv |
2R1N-EPL | data/2R/2R1N-EPL/2R1N-EPL_ligand.pdbqt | data/2R/2R1N-EPL/2R1N-EPL_target.pdbqt | data/2R/2R1N-EPL/2R1N-EPL_decoys.pdbqt | data/2R/2R1N-EPL/2R1N-EPL_decoy_scores.csv |
2R09-PE5 | data/2R/2R09-PE5/2R09-PE5_ligand.pdbqt | data/2R/2R09-PE5/2R09-PE5_target.pdbqt | data/2R/2R09-PE5/2R09-PE5_decoys.pdbqt | data/2R/2R09-PE5/2R09-PE5_decoy_scores.csv |
7S6Y-8GW | data/7S/7S6Y-8GW/7S6Y-8GW_ligand.pdbqt | data/7S/7S6Y-8GW/7S6Y-8GW_target.pdbqt | data/7S/7S6Y-8GW/7S6Y-8GW_decoys.pdbqt | data/7S/7S6Y-8GW/7S6Y-8GW_decoy_scores.csv |
7SIU-9ID | data/7S/7SIU-9ID/7SIU-9ID_ligand.pdbqt | data/7S/7SIU-9ID/7SIU-9ID_target.pdbqt | data/7S/7SIU-9ID/7SIU-9ID_decoys.pdbqt | data/7S/7SIU-9ID/7SIU-9ID_decoy_scores.csv |
7SEX-93I | data/7S/7SEX-93I/7SEX-93I_ligand.pdbqt | data/7S/7SEX-93I/7SEX-93I_target.pdbqt | data/7S/7SEX-93I/7SEX-93I_decoys.pdbqt | data/7S/7SEX-93I/7SEX-93I_decoy_scores.csv |
7SKY-NAD | data/7S/7SKY-NAD/7SKY-NAD_ligand.pdbqt | data/7S/7SKY-NAD/7SKY-NAD_target.pdbqt | data/7S/7SKY-NAD/7SKY-NAD_decoys.pdbqt | data/7S/7SKY-NAD/7SKY-NAD_decoy_scores.csv |
7SKI-P34 | data/7S/7SKI-P34/7SKI-P34_ligand.pdbqt | data/7S/7SKI-P34/7SKI-P34_target.pdbqt | data/7S/7SKI-P34/7SKI-P34_decoys.pdbqt | data/7S/7SKI-P34/7SKI-P34_decoy_scores.csv |
7SGG-SHH | data/7S/7SGG-SHH/7SGG-SHH_ligand.pdbqt | data/7S/7SGG-SHH/7SGG-SHH_target.pdbqt | data/7S/7SGG-SHH/7SGG-SHH_decoys.pdbqt | data/7S/7SGG-SHH/7SGG-SHH_decoy_scores.csv |
7SNW-9YR | data/7S/7SNW-9YR/7SNW-9YR_ligand.pdbqt | data/7S/7SNW-9YR/7SNW-9YR_target.pdbqt | data/7S/7SNW-9YR/7SNW-9YR_decoys.pdbqt | data/7S/7SNW-9YR/7SNW-9YR_decoy_scores.csv |
7S3X-H4B | data/7S/7S3X-H4B/7S3X-H4B_ligand.pdbqt | data/7S/7S3X-H4B/7S3X-H4B_target.pdbqt | data/7S/7S3X-H4B/7S3X-H4B_decoys.pdbqt | data/7S/7S3X-H4B/7S3X-H4B_decoy_scores.csv |
7SED-8VD | data/7S/7SED-8VD/7SED-8VD_ligand.pdbqt | data/7S/7SED-8VD/7SED-8VD_target.pdbqt | data/7S/7SED-8VD/7SED-8VD_decoys.pdbqt | data/7S/7SED-8VD/7SED-8VD_decoy_scores.csv |
7SLZ-9QU | data/7S/7SLZ-9QU/7SLZ-9QU_ligand.pdbqt | data/7S/7SLZ-9QU/7SLZ-9QU_target.pdbqt | data/7S/7SLZ-9QU/7SLZ-9QU_decoys.pdbqt | data/7S/7SLZ-9QU/7SLZ-9QU_decoy_scores.csv |
7SUJ-BYL | data/7S/7SUJ-BYL/7SUJ-BYL_ligand.pdbqt | data/7S/7SUJ-BYL/7SUJ-BYL_target.pdbqt | data/7S/7SUJ-BYL/7SUJ-BYL_decoys.pdbqt | data/7S/7SUJ-BYL/7SUJ-BYL_decoy_scores.csv |
7S95-ADE | data/7S/7S95-ADE/7S95-ADE_ligand.pdbqt | data/7S/7S95-ADE/7S95-ADE_target.pdbqt | data/7S/7S95-ADE/7S95-ADE_decoys.pdbqt | data/7S/7S95-ADE/7S95-ADE_decoy_scores.csv |
7SV1-U6V | data/7S/7SV1-U6V/7SV1-U6V_ligand.pdbqt | data/7S/7SV1-U6V/7SV1-U6V_target.pdbqt | data/7S/7SV1-U6V/7SV1-U6V_decoys.pdbqt | data/7S/7SV1-U6V/7SV1-U6V_decoy_scores.csv |
7SZ3-APR | data/7S/7SZ3-APR/7SZ3-APR_ligand.pdbqt | data/7S/7SZ3-APR/7SZ3-APR_target.pdbqt | data/7S/7SZ3-APR/7SZ3-APR_decoys.pdbqt | data/7S/7SZ3-APR/7SZ3-APR_decoy_scores.csv |
7SEZ-8NK | data/7S/7SEZ-8NK/7SEZ-8NK_ligand.pdbqt | data/7S/7SEZ-8NK/7SEZ-8NK_target.pdbqt | data/7S/7SEZ-8NK/7SEZ-8NK_decoys.pdbqt | data/7S/7SEZ-8NK/7SEZ-8NK_decoy_scores.csv |
7SZ2-ATP | data/7S/7SZ2-ATP/7SZ2-ATP_ligand.pdbqt | data/7S/7SZ2-ATP/7SZ2-ATP_target.pdbqt | data/7S/7SZ2-ATP/7SZ2-ATP_decoys.pdbqt | data/7S/7SZ2-ATP/7SZ2-ATP_decoy_scores.csv |
7S8A-12P | data/7S/7S8A-12P/7S8A-12P_ligand.pdbqt | data/7S/7S8A-12P/7S8A-12P_target.pdbqt | data/7S/7S8A-12P/7S8A-12P_decoys.pdbqt | data/7S/7S8A-12P/7S8A-12P_decoy_scores.csv |
7SEB-8XF | data/7S/7SEB-8XF/7SEB-8XF_ligand.pdbqt | data/7S/7SEB-8XF/7SEB-8XF_target.pdbqt | data/7S/7SEB-8XF/7SEB-8XF_decoys.pdbqt | data/7S/7SEB-8XF/7SEB-8XF_decoy_scores.csv |
7S72-8I0 | data/7S/7S72-8I0/7S72-8I0_ligand.pdbqt | data/7S/7S72-8I0/7S72-8I0_target.pdbqt | data/7S/7S72-8I0/7S72-8I0_decoys.pdbqt | data/7S/7S72-8I0/7S72-8I0_decoy_scores.csv |
7S0U-MTA | data/7S/7S0U-MTA/7S0U-MTA_ligand.pdbqt | data/7S/7S0U-MTA/7S0U-MTA_target.pdbqt | data/7S/7S0U-MTA/7S0U-MTA_decoys.pdbqt | data/7S/7S0U-MTA/7S0U-MTA_decoy_scores.csv |
7SJH-9IU | data/7S/7SJH-9IU/7SJH-9IU_ligand.pdbqt | data/7S/7SJH-9IU/7SJH-9IU_target.pdbqt | data/7S/7SJH-9IU/7SJH-9IU_decoys.pdbqt | data/7S/7SJH-9IU/7SJH-9IU_decoy_scores.csv |
7S3Y-H4B | data/7S/7S3Y-H4B/7S3Y-H4B_ligand.pdbqt | data/7S/7S3Y-H4B/7S3Y-H4B_target.pdbqt | data/7S/7S3Y-H4B/7S3Y-H4B_decoys.pdbqt | data/7S/7S3Y-H4B/7S3Y-H4B_decoy_scores.csv |
7SIF-BTB | data/7S/7SIF-BTB/7SIF-BTB_ligand.pdbqt | data/7S/7SIF-BTB/7SIF-BTB_target.pdbqt | data/7S/7SIF-BTB/7SIF-BTB_decoys.pdbqt | data/7S/7SIF-BTB/7SIF-BTB_decoy_scores.csv |
7S4M-D10 | data/7S/7S4M-D10/7S4M-D10_ligand.pdbqt | data/7S/7S4M-D10/7S4M-D10_target.pdbqt | data/7S/7S4M-D10/7S4M-D10_decoys.pdbqt | data/7S/7S4M-D10/7S4M-D10_decoy_scores.csv |
7SOL-AMP | data/7S/7SOL-AMP/7SOL-AMP_ligand.pdbqt | data/7S/7SOL-AMP/7SOL-AMP_target.pdbqt | data/7S/7SOL-AMP/7SOL-AMP_decoys.pdbqt | data/7S/7SOL-AMP/7SOL-AMP_decoy_scores.csv |
7SV8-U7J | data/7S/7SV8-U7J/7SV8-U7J_ligand.pdbqt | data/7S/7SV8-U7J/7SV8-U7J_target.pdbqt | data/7S/7SV8-U7J/7SV8-U7J_decoys.pdbqt | data/7S/7SV8-U7J/7SV8-U7J_decoy_scores.csv |
7SI9-4WI | data/7S/7SI9-4WI/7SI9-4WI_ligand.pdbqt | data/7S/7SI9-4WI/7SI9-4WI_target.pdbqt | data/7S/7SI9-4WI/7SI9-4WI_decoys.pdbqt | data/7S/7SI9-4WI/7SI9-4WI_decoy_scores.csv |
7S8B-Y01 | data/7S/7S8B-Y01/7S8B-Y01_ligand.pdbqt | data/7S/7S8B-Y01/7S8B-Y01_target.pdbqt | null | null |
7SZD-DVO | data/7S/7SZD-DVO/7SZD-DVO_ligand.pdbqt | data/7S/7SZD-DVO/7SZD-DVO_target.pdbqt | data/7S/7SZD-DVO/7SZD-DVO_decoys.pdbqt | data/7S/7SZD-DVO/7SZD-DVO_decoy_scores.csv |
7SZA-DUI | data/7S/7SZA-DUI/7SZA-DUI_ligand.pdbqt | data/7S/7SZA-DUI/7SZA-DUI_target.pdbqt | data/7S/7SZA-DUI/7SZA-DUI_decoys.pdbqt | data/7S/7SZA-DUI/7SZA-DUI_decoy_scores.csv |
7SPS-A0E | data/7S/7SPS-A0E/7SPS-A0E_ligand.pdbqt | data/7S/7SPS-A0E/7SPS-A0E_target.pdbqt | data/7S/7SPS-A0E/7SPS-A0E_decoys.pdbqt | data/7S/7SPS-A0E/7SPS-A0E_decoy_scores.csv |
7SPS-OLC | data/7S/7SPS-OLC/7SPS-OLC_ligand.pdbqt | data/7S/7SPS-OLC/7SPS-OLC_target.pdbqt | data/7S/7SPS-OLC/7SPS-OLC_decoys.pdbqt | data/7S/7SPS-OLC/7SPS-OLC_decoy_scores.csv |
7S97-CYC | data/7S/7S97-CYC/7S97-CYC_ligand.pdbqt | data/7S/7S97-CYC/7S97-CYC_target.pdbqt | data/7S/7S97-CYC/7S97-CYC_decoys.pdbqt | data/7S/7S97-CYC/7S97-CYC_decoy_scores.csv |
7SGV-L30 | data/7S/7SGV-L30/7SGV-L30_ligand.pdbqt | data/7S/7SGV-L30/7SGV-L30_target.pdbqt | data/7S/7SGV-L30/7SGV-L30_decoys.pdbqt | data/7S/7SGV-L30/7SGV-L30_decoy_scores.csv |
7SPT-OLC | data/7S/7SPT-OLC/7SPT-OLC_ligand.pdbqt | data/7S/7SPT-OLC/7SPT-OLC_target.pdbqt | data/7S/7SPT-OLC/7SPT-OLC_decoys.pdbqt | data/7S/7SPT-OLC/7SPT-OLC_decoy_scores.csv |
7SH1-ADP | data/7S/7SH1-ADP/7SH1-ADP_ligand.pdbqt | data/7S/7SH1-ADP/7SH1-ADP_target.pdbqt | data/7S/7SH1-ADP/7SH1-ADP_decoys.pdbqt | data/7S/7SH1-ADP/7SH1-ADP_decoy_scores.csv |
7S3U-T3Q | data/7S/7S3U-T3Q/7S3U-T3Q_ligand.pdbqt | data/7S/7S3U-T3Q/7S3U-T3Q_target.pdbqt | data/7S/7S3U-T3Q/7S3U-T3Q_decoys.pdbqt | data/7S/7S3U-T3Q/7S3U-T3Q_decoy_scores.csv |
7S96-CYC | data/7S/7S96-CYC/7S96-CYC_ligand.pdbqt | data/7S/7S96-CYC/7S96-CYC_target.pdbqt | data/7S/7S96-CYC/7S96-CYC_decoys.pdbqt | data/7S/7S96-CYC/7S96-CYC_decoy_scores.csv |
7SNJ-P4G | data/7S/7SNJ-P4G/7SNJ-P4G_ligand.pdbqt | data/7S/7SNJ-P4G/7SNJ-P4G_target.pdbqt | data/7S/7SNJ-P4G/7SNJ-P4G_decoys.pdbqt | data/7S/7SNJ-P4G/7SNJ-P4G_decoy_scores.csv |
7SA3-LMT | data/7S/7SA3-LMT/7SA3-LMT_ligand.pdbqt | data/7S/7SA3-LMT/7SA3-LMT_target.pdbqt | data/7S/7SA3-LMT/7SA3-LMT_decoys.pdbqt | data/7S/7SA3-LMT/7SA3-LMT_decoy_scores.csv |
7SEY-92W | data/7S/7SEY-92W/7SEY-92W_ligand.pdbqt | data/7S/7SEY-92W/7SEY-92W_target.pdbqt | data/7S/7SEY-92W/7SEY-92W_decoys.pdbqt | data/7S/7SEY-92W/7SEY-92W_decoy_scores.csv |
7S96-DBV | data/7S/7S96-DBV/7S96-DBV_ligand.pdbqt | data/7S/7S96-DBV/7S96-DBV_target.pdbqt | data/7S/7S96-DBV/7S96-DBV_decoys.pdbqt | data/7S/7S96-DBV/7S96-DBV_decoy_scores.csv |
7SOL-IHP | data/7S/7SOL-IHP/7SOL-IHP_ligand.pdbqt | data/7S/7SOL-IHP/7SOL-IHP_target.pdbqt | data/7S/7SOL-IHP/7SOL-IHP_decoys.pdbqt | data/7S/7SOL-IHP/7SOL-IHP_decoy_scores.csv |
7S6W-8G9 | data/7S/7S6W-8G9/7S6W-8G9_ligand.pdbqt | data/7S/7S6W-8G9/7S6W-8G9_target.pdbqt | data/7S/7S6W-8G9/7S6W-8G9_decoys.pdbqt | data/7S/7S6W-8G9/7S6W-8G9_decoy_scores.csv |
7SFB-90U | data/7S/7SFB-90U/7SFB-90U_ligand.pdbqt | data/7S/7SFB-90U/7SFB-90U_target.pdbqt | data/7S/7SFB-90U/7SFB-90U_decoys.pdbqt | data/7S/7SFB-90U/7SFB-90U_decoy_scores.csv |
7SPX-HC4 | data/7S/7SPX-HC4/7SPX-HC4_ligand.pdbqt | data/7S/7SPX-HC4/7SPX-HC4_target.pdbqt | data/7S/7SPX-HC4/7SPX-HC4_decoys.pdbqt | data/7S/7SPX-HC4/7SPX-HC4_decoy_scores.csv |
7SJG-9IX | data/7S/7SJG-9IX/7SJG-9IX_ligand.pdbqt | data/7S/7SJG-9IX/7SJG-9IX_target.pdbqt | data/7S/7SJG-9IX/7SJG-9IX_decoys.pdbqt | data/7S/7SJG-9IX/7SJG-9IX_decoy_scores.csv |
7S4I-PLC | data/7S/7S4I-PLC/7S4I-PLC_ligand.pdbqt | data/7S/7S4I-PLC/7S4I-PLC_target.pdbqt | data/7S/7S4I-PLC/7S4I-PLC_decoys.pdbqt | data/7S/7S4I-PLC/7S4I-PLC_decoy_scores.csv |
7S1P-SFG | data/7S/7S1P-SFG/7S1P-SFG_ligand.pdbqt | data/7S/7S1P-SFG/7S1P-SFG_target.pdbqt | data/7S/7S1P-SFG/7S1P-SFG_decoys.pdbqt | data/7S/7S1P-SFG/7S1P-SFG_decoy_scores.csv |
7SI4-9JL | data/7S/7SI4-9JL/7SI4-9JL_ligand.pdbqt | data/7S/7SI4-9JL/7SI4-9JL_target.pdbqt | data/7S/7SI4-9JL/7SI4-9JL_decoys.pdbqt | data/7S/7SI4-9JL/7SI4-9JL_decoy_scores.csv |
7SJC-9NI | data/7S/7SJC-9NI/7SJC-9NI_ligand.pdbqt | data/7S/7SJC-9NI/7SJC-9NI_target.pdbqt | data/7S/7SJC-9NI/7SJC-9NI_decoys.pdbqt | data/7S/7SJC-9NI/7SJC-9NI_decoy_scores.csv |
7S4J-HXG | data/7S/7S4J-HXG/7S4J-HXG_ligand.pdbqt | data/7S/7S4J-HXG/7S4J-HXG_target.pdbqt | data/7S/7S4J-HXG/7S4J-HXG_decoys.pdbqt | data/7S/7S4J-HXG/7S4J-HXG_decoy_scores.csv |
7SSS-8PP | data/7S/7SSS-8PP/7SSS-8PP_ligand.pdbqt | data/7S/7SSS-8PP/7SSS-8PP_target.pdbqt | data/7S/7SSS-8PP/7SSS-8PP_decoys.pdbqt | data/7S/7SSS-8PP/7SSS-8PP_decoy_scores.csv |
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