Datasets:
jiangteam
/
DecoyDB

Dataset card Data Studio Files
xet
Community
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complex_id
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6
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ligand_pdbqt_path
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34
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target_pdbqt_path
stringlengths
34
38
decoys_pdbqt_path
stringlengths
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decoy_scores_csv_path
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5KOK-SAH
data/5K/5KOK-SAH/5KOK-SAH_ligand.pdbqt
data/5K/5KOK-SAH/5KOK-SAH_target.pdbqt
data/5K/5KOK-SAH/5KOK-SAH_decoys.pdbqt
data/5K/5KOK-SAH/5KOK-SAH_decoy_scores.csv
5KGU-THP
data/5K/5KGU-THP/5KGU-THP_ligand.pdbqt
data/5K/5KGU-THP/5KGU-THP_target.pdbqt
data/5K/5KGU-THP/5KGU-THP_decoys.pdbqt
data/5K/5KGU-THP/5KGU-THP_decoy_scores.csv
5KRV-ARG
data/5K/5KRV-ARG/5KRV-ARG_ligand.pdbqt
data/5K/5KRV-ARG/5KRV-ARG_target.pdbqt
data/5K/5KRV-ARG/5KRV-ARG_decoys.pdbqt
data/5K/5KRV-ARG/5KRV-ARG_decoy_scores.csv
5KWH-6XT
data/5K/5KWH-6XT/5KWH-6XT_ligand.pdbqt
data/5K/5KWH-6XT/5KWH-6XT_target.pdbqt
data/5K/5KWH-6XT/5KWH-6XT_decoys.pdbqt
data/5K/5KWH-6XT/5KWH-6XT_decoy_scores.csv
5K1W-8K6
data/5K/5K1W-8K6/5K1W-8K6_ligand.pdbqt
data/5K/5K1W-8K6/5K1W-8K6_target.pdbqt
data/5K/5K1W-8K6/5K1W-8K6_decoys.pdbqt
data/5K/5K1W-8K6/5K1W-8K6_decoy_scores.csv
5KSI-DG2
data/5K/5KSI-DG2/5KSI-DG2_ligand.pdbqt
data/5K/5KSI-DG2/5KSI-DG2_target.pdbqt
data/5K/5KSI-DG2/5KSI-DG2_decoys.pdbqt
data/5K/5KSI-DG2/5KSI-DG2_decoy_scores.csv
5KCF-OB4
data/5K/5KCF-OB4/5KCF-OB4_ligand.pdbqt
data/5K/5KCF-OB4/5KCF-OB4_target.pdbqt
data/5K/5KCF-OB4/5KCF-OB4_decoys.pdbqt
data/5K/5KCF-OB4/5KCF-OB4_decoy_scores.csv
5KAO-G43
data/5K/5KAO-G43/5KAO-G43_ligand.pdbqt
data/5K/5KAO-G43/5KAO-G43_target.pdbqt
data/5K/5KAO-G43/5KAO-G43_decoys.pdbqt
data/5K/5KAO-G43/5KAO-G43_decoy_scores.csv
5KMK-6UG
data/5K/5KMK-6UG/5KMK-6UG_ligand.pdbqt
data/5K/5KMK-6UG/5KMK-6UG_target.pdbqt
data/5K/5KMK-6UG/5KMK-6UG_decoys.pdbqt
data/5K/5KMK-6UG/5KMK-6UG_decoy_scores.csv
5K61-GLN
data/5K/5K61-GLN/5K61-GLN_ligand.pdbqt
data/5K/5K61-GLN/5K61-GLN_target.pdbqt
data/5K/5K61-GLN/5K61-GLN_decoys.pdbqt
data/5K/5K61-GLN/5K61-GLN_decoy_scores.csv
5K8Y-P6G
data/5K/5K8Y-P6G/5K8Y-P6G_ligand.pdbqt
data/5K/5K8Y-P6G/5K8Y-P6G_target.pdbqt
data/5K/5K8Y-P6G/5K8Y-P6G_decoys.pdbqt
data/5K/5K8Y-P6G/5K8Y-P6G_decoy_scores.csv
5KAM-IMP
data/5K/5KAM-IMP/5KAM-IMP_ligand.pdbqt
data/5K/5KAM-IMP/5KAM-IMP_target.pdbqt
data/5K/5KAM-IMP/5KAM-IMP_decoys.pdbqt
data/5K/5KAM-IMP/5KAM-IMP_decoy_scores.csv
5K0X-K0X
data/5K/5K0X-K0X/5K0X-K0X_ligand.pdbqt
data/5K/5K0X-K0X/5K0X-K0X_target.pdbqt
data/5K/5K0X-K0X/5K0X-K0X_decoys.pdbqt
data/5K/5K0X-K0X/5K0X-K0X_decoy_scores.csv
5KPT-ANP
data/5K/5KPT-ANP/5KPT-ANP_ligand.pdbqt
data/5K/5KPT-ANP/5KPT-ANP_target.pdbqt
data/5K/5KPT-ANP/5KPT-ANP_decoys.pdbqt
data/5K/5KPT-ANP/5KPT-ANP_decoy_scores.csv
5KIX-THP
data/5K/5KIX-THP/5KIX-THP_ligand.pdbqt
data/5K/5KIX-THP/5KIX-THP_target.pdbqt
data/5K/5KIX-THP/5KIX-THP_decoys.pdbqt
data/5K/5KIX-THP/5KIX-THP_decoy_scores.csv
5KSJ-S1P
data/5K/5KSJ-S1P/5KSJ-S1P_ligand.pdbqt
data/5K/5KSJ-S1P/5KSJ-S1P_target.pdbqt
data/5K/5KSJ-S1P/5KSJ-S1P_decoys.pdbqt
data/5K/5KSJ-S1P/5KSJ-S1P_decoy_scores.csv
5KHI-6SX
data/5K/5KHI-6SX/5KHI-6SX_ligand.pdbqt
data/5K/5KHI-6SX/5KHI-6SX_target.pdbqt
data/5K/5KHI-6SX/5KHI-6SX_decoys.pdbqt
data/5K/5KHI-6SX/5KHI-6SX_decoy_scores.csv
5K4M-SV7
data/5K/5K4M-SV7/5K4M-SV7_ligand.pdbqt
data/5K/5K4M-SV7/5K4M-SV7_target.pdbqt
data/5K/5K4M-SV7/5K4M-SV7_decoys.pdbqt
data/5K/5K4M-SV7/5K4M-SV7_decoy_scores.csv
5K75-6QX
data/5K/5K75-6QX/5K75-6QX_ligand.pdbqt
data/5K/5K75-6QX/5K75-6QX_target.pdbqt
data/5K/5K75-6QX/5K75-6QX_decoys.pdbqt
data/5K/5K75-6QX/5K75-6QX_decoy_scores.csv
5KIT-6TA
data/5K/5KIT-6TA/5KIT-6TA_ligand.pdbqt
data/5K/5KIT-6TA/5KIT-6TA_target.pdbqt
data/5K/5KIT-6TA/5KIT-6TA_decoys.pdbqt
data/5K/5KIT-6TA/5KIT-6TA_decoy_scores.csv
5KGJ-X6X
data/5K/5KGJ-X6X/5KGJ-X6X_ligand.pdbqt
data/5K/5KGJ-X6X/5KGJ-X6X_target.pdbqt
data/5K/5KGJ-X6X/5KGJ-X6X_decoys.pdbqt
data/5K/5KGJ-X6X/5KGJ-X6X_decoy_scores.csv
5KF8-GCS
data/5K/5KF8-GCS/5KF8-GCS_ligand.pdbqt
data/5K/5KF8-GCS/5KF8-GCS_target.pdbqt
data/5K/5KF8-GCS/5KF8-GCS_decoys.pdbqt
data/5K/5KF8-GCS/5KF8-GCS_decoy_scores.csv
5KMC-6UU
data/5K/5KMC-6UU/5KMC-6UU_ligand.pdbqt
data/5K/5KMC-6UU/5KMC-6UU_target.pdbqt
data/5K/5KMC-6UU/5KMC-6UU_decoys.pdbqt
data/5K/5KMC-6UU/5KMC-6UU_decoy_scores.csv
5KVA-SAM
data/5K/5KVA-SAM/5KVA-SAM_ligand.pdbqt
data/5K/5KVA-SAM/5KVA-SAM_target.pdbqt
data/5K/5KVA-SAM/5KVA-SAM_decoys.pdbqt
data/5K/5KVA-SAM/5KVA-SAM_decoy_scores.csv
5K13-6Q7
data/5K/5K13-6Q7/5K13-6Q7_ligand.pdbqt
data/5K/5K13-6Q7/5K13-6Q7_target.pdbqt
data/5K/5K13-6Q7/5K13-6Q7_decoys.pdbqt
data/5K/5K13-6Q7/5K13-6Q7_decoy_scores.csv
5KRT-6W6
data/5K/5KRT-6W6/5KRT-6W6_ligand.pdbqt
data/5K/5KRT-6W6/5KRT-6W6_target.pdbqt
null
null
5K2A-ZMA
data/5K/5K2A-ZMA/5K2A-ZMA_ligand.pdbqt
data/5K/5K2A-ZMA/5K2A-ZMA_target.pdbqt
data/5K/5K2A-ZMA/5K2A-ZMA_decoys.pdbqt
data/5K/5K2A-ZMA/5K2A-ZMA_decoy_scores.csv
5KBZ-3B2
data/5K/5KBZ-3B2/5KBZ-3B2_ligand.pdbqt
data/5K/5KBZ-3B2/5KBZ-3B2_target.pdbqt
data/5K/5KBZ-3B2/5KBZ-3B2_decoys.pdbqt
data/5K/5KBZ-3B2/5KBZ-3B2_decoy_scores.csv
5KQY-017
data/5K/5KQY-017/5KQY-017_ligand.pdbqt
data/5K/5KQY-017/5KQY-017_target.pdbqt
data/5K/5KQY-017/5KQY-017_decoys.pdbqt
data/5K/5KQY-017/5KQY-017_decoy_scores.csv
5KUP-6XL
data/5K/5KUP-6XL/5KUP-6XL_ligand.pdbqt
data/5K/5KUP-6XL/5KUP-6XL_target.pdbqt
data/5K/5KUP-6XL/5KUP-6XL_decoys.pdbqt
data/5K/5KUP-6XL/5KUP-6XL_decoy_scores.csv
5KF8-EP1
data/5K/5KF8-EP1/5KF8-EP1_ligand.pdbqt
data/5K/5KF8-EP1/5KF8-EP1_target.pdbqt
data/5K/5KF8-EP1/5KF8-EP1_decoys.pdbqt
data/5K/5KF8-EP1/5KF8-EP1_decoy_scores.csv
5K1F-IMP
data/5K/5K1F-IMP/5K1F-IMP_ligand.pdbqt
data/5K/5K1F-IMP/5K1F-IMP_target.pdbqt
data/5K/5K1F-IMP/5K1F-IMP_decoys.pdbqt
data/5K/5K1F-IMP/5K1F-IMP_decoy_scores.csv
5KM2-C5P
data/5K/5KM2-C5P/5KM2-C5P_ligand.pdbqt
data/5K/5KM2-C5P/5KM2-C5P_target.pdbqt
data/5K/5KM2-C5P/5KM2-C5P_decoys.pdbqt
data/5K/5KM2-C5P/5KM2-C5P_decoy_scores.csv
5KPR-PAU
data/5K/5KPR-PAU/5KPR-PAU_ligand.pdbqt
data/5K/5KPR-PAU/5KPR-PAU_target.pdbqt
data/5K/5KPR-PAU/5KPR-PAU_decoys.pdbqt
data/5K/5KPR-PAU/5KPR-PAU_decoy_scores.csv
5K1Q-FMN
data/5K/5K1Q-FMN/5K1Q-FMN_ligand.pdbqt
data/5K/5K1Q-FMN/5K1Q-FMN_target.pdbqt
data/5K/5K1Q-FMN/5K1Q-FMN_decoys.pdbqt
data/5K/5K1Q-FMN/5K1Q-FMN_decoy_scores.csv
5K2C-CLR
data/5K/5K2C-CLR/5K2C-CLR_ligand.pdbqt
data/5K/5K2C-CLR/5K2C-CLR_target.pdbqt
data/5K/5K2C-CLR/5K2C-CLR_decoys.pdbqt
data/5K/5K2C-CLR/5K2C-CLR_decoy_scores.csv
5K8F-6R9
data/5K/5K8F-6R9/5K8F-6R9_ligand.pdbqt
data/5K/5K8F-6R9/5K8F-6R9_target.pdbqt
data/5K/5K8F-6R9/5K8F-6R9_decoys.pdbqt
data/5K/5K8F-6R9/5K8F-6R9_decoy_scores.csv
5K0H-6PK
data/5K/5K0H-6PK/5K0H-6PK_ligand.pdbqt
data/5K/5K0H-6PK/5K0H-6PK_target.pdbqt
data/5K/5K0H-6PK/5K0H-6PK_decoys.pdbqt
data/5K/5K0H-6PK/5K0H-6PK_decoy_scores.csv
5K0F-6P1
data/5K/5K0F-6P1/5K0F-6P1_ligand.pdbqt
data/5K/5K0F-6P1/5K0F-6P1_target.pdbqt
data/5K/5K0F-6P1/5K0F-6P1_decoys.pdbqt
data/5K/5K0F-6P1/5K0F-6P1_decoy_scores.csv
5KGD-6SL
data/5K/5KGD-6SL/5KGD-6SL_ligand.pdbqt
data/5K/5KGD-6SL/5KGD-6SL_target.pdbqt
data/5K/5KGD-6SL/5KGD-6SL_decoys.pdbqt
data/5K/5KGD-6SL/5KGD-6SL_decoy_scores.csv
5K45-GLU
data/5K/5K45-GLU/5K45-GLU_ligand.pdbqt
data/5K/5K45-GLU/5K45-GLU_target.pdbqt
data/5K/5K45-GLU/5K45-GLU_decoys.pdbqt
data/5K/5K45-GLU/5K45-GLU_decoy_scores.csv
5KNK-LMT
data/5K/5KNK-LMT/5KNK-LMT_ligand.pdbqt
data/5K/5KNK-LMT/5KNK-LMT_target.pdbqt
data/5K/5KNK-LMT/5KNK-LMT_decoys.pdbqt
data/5K/5KNK-LMT/5KNK-LMT_decoy_scores.csv
5KP3-EQU
data/5K/5KP3-EQU/5KP3-EQU_ligand.pdbqt
data/5K/5KP3-EQU/5KP3-EQU_target.pdbqt
data/5K/5KP3-EQU/5KP3-EQU_decoys.pdbqt
data/5K/5KP3-EQU/5KP3-EQU_decoy_scores.csv
5K01-6OW
data/5K/5K01-6OW/5K01-6OW_ligand.pdbqt
data/5K/5K01-6OW/5K01-6OW_target.pdbqt
data/5K/5K01-6OW/5K01-6OW_decoys.pdbqt
data/5K/5K01-6OW/5K01-6OW_decoy_scores.csv
5K1U-TNF
data/5K/5K1U-TNF/5K1U-TNF_ligand.pdbqt
data/5K/5K1U-TNF/5K1U-TNF_target.pdbqt
data/5K/5K1U-TNF/5K1U-TNF_decoys.pdbqt
data/5K/5K1U-TNF/5K1U-TNF_decoy_scores.csv
5KCQ-GST
data/5K/5KCQ-GST/5KCQ-GST_ligand.pdbqt
data/5K/5KCQ-GST/5KCQ-GST_target.pdbqt
data/5K/5KCQ-GST/5KCQ-GST_decoys.pdbqt
data/5K/5KCQ-GST/5KCQ-GST_decoy_scores.csv
5KDA-GEN
data/5K/5KDA-GEN/5KDA-GEN_ligand.pdbqt
data/5K/5KDA-GEN/5KDA-GEN_target.pdbqt
data/5K/5KDA-GEN/5KDA-GEN_decoys.pdbqt
data/5K/5KDA-GEN/5KDA-GEN_decoy_scores.csv
5KDT-6RV
data/5K/5KDT-6RV/5KDT-6RV_ligand.pdbqt
data/5K/5KDT-6RV/5KDT-6RV_target.pdbqt
data/5K/5KDT-6RV/5KDT-6RV_decoys.pdbqt
data/5K/5KDT-6RV/5KDT-6RV_decoy_scores.csv
5K4Q-NAD
data/5K/5K4Q-NAD/5K4Q-NAD_ligand.pdbqt
data/5K/5K4Q-NAD/5K4Q-NAD_target.pdbqt
data/5K/5K4Q-NAD/5K4Q-NAD_decoys.pdbqt
data/5K/5K4Q-NAD/5K4Q-NAD_decoy_scores.csv
5KP2-OCA
data/5K/5KP2-OCA/5KP2-OCA_ligand.pdbqt
data/5K/5KP2-OCA/5KP2-OCA_target.pdbqt
data/5K/5KP2-OCA/5KP2-OCA_decoys.pdbqt
data/5K/5KP2-OCA/5KP2-OCA_decoy_scores.csv
5K7U-SAM
data/5K/5K7U-SAM/5K7U-SAM_ligand.pdbqt
data/5K/5K7U-SAM/5K7U-SAM_target.pdbqt
data/5K/5K7U-SAM/5K7U-SAM_decoys.pdbqt
data/5K/5K7U-SAM/5K7U-SAM_decoy_scores.csv
5KRO-6WW
data/5K/5KRO-6WW/5KRO-6WW_ligand.pdbqt
data/5K/5KRO-6WW/5KRO-6WW_target.pdbqt
data/5K/5KRO-6WW/5KRO-6WW_decoys.pdbqt
data/5K/5KRO-6WW/5KRO-6WW_decoy_scores.csv
5KMM-6UJ
data/5K/5KMM-6UJ/5KMM-6UJ_ligand.pdbqt
data/5K/5KMM-6UJ/5KMM-6UJ_target.pdbqt
data/5K/5KMM-6UJ/5KMM-6UJ_decoys.pdbqt
data/5K/5KMM-6UJ/5KMM-6UJ_decoy_scores.csv
5K2B-OLC
data/5K/5K2B-OLC/5K2B-OLC_ligand.pdbqt
data/5K/5K2B-OLC/5K2B-OLC_target.pdbqt
data/5K/5K2B-OLC/5K2B-OLC_decoys.pdbqt
data/5K/5K2B-OLC/5K2B-OLC_decoy_scores.csv
5K7W-SAH
data/5K/5K7W-SAH/5K7W-SAH_ligand.pdbqt
data/5K/5K7W-SAH/5K7W-SAH_target.pdbqt
data/5K/5K7W-SAH/5K7W-SAH_decoys.pdbqt
data/5K/5K7W-SAH/5K7W-SAH_decoy_scores.csv
5K53-STE
data/5K/5K53-STE/5K53-STE_ligand.pdbqt
data/5K/5K53-STE/5K53-STE_target.pdbqt
data/5K/5K53-STE/5K53-STE_decoys.pdbqt
data/5K/5K53-STE/5K53-STE_decoy_scores.csv
5KTD-QUH
data/5K/5KTD-QUH/5KTD-QUH_ligand.pdbqt
data/5K/5KTD-QUH/5KTD-QUH_target.pdbqt
data/5K/5KTD-QUH/5KTD-QUH_decoys.pdbqt
data/5K/5KTD-QUH/5KTD-QUH_decoy_scores.csv
5KL0-G16
data/5K/5KL0-G16/5KL0-G16_ligand.pdbqt
data/5K/5KL0-G16/5KL0-G16_target.pdbqt
data/5K/5KL0-G16/5KL0-G16_decoys.pdbqt
data/5K/5KL0-G16/5KL0-G16_decoy_scores.csv
5KR0-478
data/5K/5KR0-478/5KR0-478_ligand.pdbqt
data/5K/5KR0-478/5KR0-478_target.pdbqt
data/5K/5KR0-478/5KR0-478_decoys.pdbqt
data/5K/5KR0-478/5KR0-478_decoy_scores.csv
5K8I-ATP
data/5K/5K8I-ATP/5K8I-ATP_ligand.pdbqt
data/5K/5K8I-ATP/5K8I-ATP_target.pdbqt
data/5K/5K8I-ATP/5K8I-ATP_decoys.pdbqt
data/5K/5K8I-ATP/5K8I-ATP_decoy_scores.csv
5K0S-0OU
data/5K/5K0S-0OU/5K0S-0OU_ligand.pdbqt
data/5K/5K0S-0OU/5K0S-0OU_target.pdbqt
data/5K/5K0S-0OU/5K0S-0OU_decoys.pdbqt
data/5K/5K0S-0OU/5K0S-0OU_decoy_scores.csv
5K08-TCE
data/5K/5K08-TCE/5K08-TCE_ligand.pdbqt
data/5K/5K08-TCE/5K08-TCE_target.pdbqt
null
null
5KB3-4CT
data/5K/5KB3-4CT/5KB3-4CT_ligand.pdbqt
data/5K/5KB3-4CT/5KB3-4CT_target.pdbqt
data/5K/5KB3-4CT/5KB3-4CT_decoys.pdbqt
data/5K/5KB3-4CT/5KB3-4CT_decoy_scores.csv
5KJM-SAM
data/5K/5KJM-SAM/5KJM-SAM_ligand.pdbqt
data/5K/5KJM-SAM/5KJM-SAM_target.pdbqt
data/5K/5KJM-SAM/5KJM-SAM_decoys.pdbqt
data/5K/5KJM-SAM/5KJM-SAM_decoy_scores.csv
5KQS-SAM
data/5K/5KQS-SAM/5KQS-SAM_ligand.pdbqt
data/5K/5KQS-SAM/5KQS-SAM_target.pdbqt
data/5K/5KQS-SAM/5KQS-SAM_decoys.pdbqt
data/5K/5KQS-SAM/5KQS-SAM_decoy_scores.csv
5KKC-6V0
data/5K/5KKC-6V0/5KKC-6V0_ligand.pdbqt
data/5K/5KKC-6V0/5KKC-6V0_target.pdbqt
data/5K/5KKC-6V0/5KKC-6V0_decoys.pdbqt
data/5K/5KKC-6V0/5KKC-6V0_decoy_scores.csv
5KSI-S1P
data/5K/5KSI-S1P/5KSI-S1P_ligand.pdbqt
data/5K/5KSI-S1P/5KSI-S1P_target.pdbqt
data/5K/5KSI-S1P/5KSI-S1P_decoys.pdbqt
data/5K/5KSI-S1P/5KSI-S1P_decoy_scores.csv
5KJY-CMP
data/5K/5KJY-CMP/5KJY-CMP_ligand.pdbqt
data/5K/5KJY-CMP/5KJY-CMP_target.pdbqt
data/5K/5KJY-CMP/5KJY-CMP_decoys.pdbqt
data/5K/5KJY-CMP/5KJY-CMP_decoy_scores.csv
5K8L-GSP
data/5K/5K8L-GSP/5K8L-GSP_ligand.pdbqt
data/5K/5K8L-GSP/5K8L-GSP_target.pdbqt
data/5K/5K8L-GSP/5K8L-GSP_decoys.pdbqt
data/5K/5K8L-GSP/5K8L-GSP_decoy_scores.csv
5KR7-6X9
data/5K/5KR7-6X9/5KR7-6X9_ligand.pdbqt
data/5K/5KR7-6X9/5KR7-6X9_target.pdbqt
data/5K/5KR7-6X9/5KR7-6X9_decoys.pdbqt
data/5K/5KR7-6X9/5KR7-6X9_decoy_scores.csv
5KPC-SAM
data/5K/5KPC-SAM/5KPC-SAM_ligand.pdbqt
data/5K/5KPC-SAM/5KPC-SAM_target.pdbqt
data/5K/5KPC-SAM/5KPC-SAM_decoys.pdbqt
data/5K/5KPC-SAM/5KPC-SAM_decoy_scores.csv
5KA3-OTA
data/5K/5KA3-OTA/5KA3-OTA_ligand.pdbqt
data/5K/5KA3-OTA/5KA3-OTA_target.pdbqt
data/5K/5KA3-OTA/5KA3-OTA_decoys.pdbqt
data/5K/5KA3-OTA/5KA3-OTA_decoy_scores.csv
5KSW-FMN
data/5K/5KSW-FMN/5KSW-FMN_ligand.pdbqt
data/5K/5KSW-FMN/5KSW-FMN_target.pdbqt
data/5K/5KSW-FMN/5KSW-FMN_decoys.pdbqt
data/5K/5KSW-FMN/5KSW-FMN_decoy_scores.csv
5KNP-6W7
data/5K/5KNP-6W7/5KNP-6W7_ligand.pdbqt
data/5K/5KNP-6W7/5KNP-6W7_target.pdbqt
data/5K/5KNP-6W7/5KNP-6W7_decoys.pdbqt
data/5K/5KNP-6W7/5KNP-6W7_decoy_scores.csv
5KAU-RHQ
data/5K/5KAU-RHQ/5KAU-RHQ_ligand.pdbqt
data/5K/5KAU-RHQ/5KAU-RHQ_target.pdbqt
data/5K/5KAU-RHQ/5KAU-RHQ_decoys.pdbqt
data/5K/5KAU-RHQ/5KAU-RHQ_decoy_scores.csv
5KM9-ADN
data/5K/5KM9-ADN/5KM9-ADN_ligand.pdbqt
data/5K/5KM9-ADN/5KM9-ADN_target.pdbqt
data/5K/5KM9-ADN/5KM9-ADN_decoys.pdbqt
data/5K/5KM9-ADN/5KM9-ADN_decoy_scores.csv
5KY5-GDP
data/5K/5KY5-GDP/5KY5-GDP_ligand.pdbqt
data/5K/5KY5-GDP/5KY5-GDP_target.pdbqt
data/5K/5KY5-GDP/5KY5-GDP_decoys.pdbqt
data/5K/5KY5-GDP/5KY5-GDP_decoy_scores.csv
5K4V-NAD
data/5K/5K4V-NAD/5K4V-NAD_ligand.pdbqt
data/5K/5K4V-NAD/5K4V-NAD_target.pdbqt
data/5K/5K4V-NAD/5K4V-NAD_decoys.pdbqt
data/5K/5K4V-NAD/5K4V-NAD_decoy_scores.csv
5KA7-OTA
data/5K/5KA7-OTA/5KA7-OTA_ligand.pdbqt
data/5K/5KA7-OTA/5KA7-OTA_target.pdbqt
data/5K/5KA7-OTA/5KA7-OTA_decoys.pdbqt
data/5K/5KA7-OTA/5KA7-OTA_decoy_scores.csv
5KPN-6WX
data/5K/5KPN-6WX/5KPN-6WX_ligand.pdbqt
data/5K/5KPN-6WX/5KPN-6WX_target.pdbqt
data/5K/5KPN-6WX/5KPN-6WX_decoys.pdbqt
data/5K/5KPN-6WX/5KPN-6WX_decoy_scores.csv
5KD9-OBT
data/5K/5KD9-OBT/5KD9-OBT_ligand.pdbqt
data/5K/5KD9-OBT/5KD9-OBT_target.pdbqt
data/5K/5KD9-OBT/5KD9-OBT_decoys.pdbqt
data/5K/5KD9-OBT/5KD9-OBT_decoy_scores.csv
5KY7-GDP
data/5K/5KY7-GDP/5KY7-GDP_ligand.pdbqt
data/5K/5KY7-GDP/5KY7-GDP_target.pdbqt
data/5K/5KY7-GDP/5KY7-GDP_decoys.pdbqt
data/5K/5KY7-GDP/5KY7-GDP_decoy_scores.csv
5KD6-DST
data/5K/5KD6-DST/5KD6-DST_ligand.pdbqt
data/5K/5KD6-DST/5KD6-DST_target.pdbqt
data/5K/5KD6-DST/5KD6-DST_decoys.pdbqt
data/5K/5KD6-DST/5KD6-DST_decoy_scores.csv
5KCT-OB7
data/5K/5KCT-OB7/5KCT-OB7_ligand.pdbqt
data/5K/5KCT-OB7/5KCT-OB7_target.pdbqt
data/5K/5KCT-OB7/5KCT-OB7_decoys.pdbqt
data/5K/5KCT-OB7/5KCT-OB7_decoy_scores.csv
5K5M-68T
data/5K/5K5M-68T/5K5M-68T_ligand.pdbqt
data/5K/5K5M-68T/5K5M-68T_target.pdbqt
data/5K/5K5M-68T/5K5M-68T_decoys.pdbqt
data/5K/5K5M-68T/5K5M-68T_decoy_scores.csv
5KKA-6V0
data/5K/5KKA-6V0/5KKA-6V0_ligand.pdbqt
data/5K/5KKA-6V0/5KKA-6V0_target.pdbqt
data/5K/5KKA-6V0/5KKA-6V0_decoys.pdbqt
data/5K/5KKA-6V0/5KKA-6V0_decoy_scores.csv
5K42-GDG
data/5K/5K42-GDG/5K42-GDG_ligand.pdbqt
data/5K/5K42-GDG/5K42-GDG_target.pdbqt
data/5K/5K42-GDG/5K42-GDG_decoys.pdbqt
data/5K/5K42-GDG/5K42-GDG_decoy_scores.csv
5KA9-OTA
data/5K/5KA9-OTA/5KA9-OTA_ligand.pdbqt
data/5K/5KA9-OTA/5KA9-OTA_target.pdbqt
data/5K/5KA9-OTA/5KA9-OTA_decoys.pdbqt
data/5K/5KA9-OTA/5KA9-OTA_decoy_scores.csv
5KWS-BGC
data/5K/5KWS-BGC/5KWS-BGC_ligand.pdbqt
data/5K/5KWS-BGC/5KWS-BGC_target.pdbqt
data/5K/5KWS-BGC/5KWS-BGC_decoys.pdbqt
data/5K/5KWS-BGC/5KWS-BGC_decoy_scores.csv
5K2C-OLC
data/5K/5K2C-OLC/5K2C-OLC_ligand.pdbqt
data/5K/5K2C-OLC/5K2C-OLC_target.pdbqt
data/5K/5K2C-OLC/5K2C-OLC_decoys.pdbqt
data/5K/5K2C-OLC/5K2C-OLC_decoy_scores.csv
5K7K-6RJ
data/5K/5K7K-6RJ/5K7K-6RJ_ligand.pdbqt
data/5K/5K7K-6RJ/5K7K-6RJ_target.pdbqt
data/5K/5K7K-6RJ/5K7K-6RJ_decoys.pdbqt
data/5K/5K7K-6RJ/5K7K-6RJ_decoy_scores.csv
5KDT-GLU
data/5K/5KDT-GLU/5KDT-GLU_ligand.pdbqt
data/5K/5KDT-GLU/5KDT-GLU_target.pdbqt
data/5K/5KDT-GLU/5KDT-GLU_decoys.pdbqt
data/5K/5KDT-GLU/5KDT-GLU_decoy_scores.csv
5KM6-6US
data/5K/5KM6-6US/5KM6-6US_ligand.pdbqt
data/5K/5KM6-6US/5KM6-6US_target.pdbqt
data/5K/5KM6-6US/5KM6-6US_decoys.pdbqt
data/5K/5KM6-6US/5KM6-6US_decoy_scores.csv
5K9D-CE9
data/5K/5K9D-CE9/5K9D-CE9_ligand.pdbqt
data/5K/5K9D-CE9/5K9D-CE9_target.pdbqt
data/5K/5K9D-CE9/5K9D-CE9_decoys.pdbqt
data/5K/5K9D-CE9/5K9D-CE9_decoy_scores.csv
5KRD-FMN
data/5K/5KRD-FMN/5KRD-FMN_ligand.pdbqt
data/5K/5KRD-FMN/5KRD-FMN_target.pdbqt
data/5K/5KRD-FMN/5KRD-FMN_decoys.pdbqt
data/5K/5KRD-FMN/5KRD-FMN_decoy_scores.csv
5KD6-LBU
data/5K/5KD6-LBU/5KD6-LBU_ligand.pdbqt
data/5K/5KD6-LBU/5KD6-LBU_target.pdbqt
data/5K/5KD6-LBU/5KD6-LBU_decoys.pdbqt
data/5K/5KD6-LBU/5KD6-LBU_decoy_scores.csv
5K2M-UN1
data/5K/5K2M-UN1/5K2M-UN1_ligand.pdbqt
data/5K/5K2M-UN1/5K2M-UN1_target.pdbqt
data/5K/5K2M-UN1/5K2M-UN1_decoys.pdbqt
data/5K/5K2M-UN1/5K2M-UN1_decoy_scores.csv
5KHX-6TE
data/5K/5KHX-6TE/5KHX-6TE_ligand.pdbqt
data/5K/5KHX-6TE/5KHX-6TE_target.pdbqt
data/5K/5KHX-6TE/5KHX-6TE_decoys.pdbqt
data/5K/5KHX-6TE/5KHX-6TE_decoy_scores.csv
5K1W-TNF
data/5K/5K1W-TNF/5K1W-TNF_ligand.pdbqt
data/5K/5K1W-TNF/5K1W-TNF_target.pdbqt
data/5K/5K1W-TNF/5K1W-TNF_decoys.pdbqt
data/5K/5K1W-TNF/5K1W-TNF_decoy_scores.csv
5KOK-S9T
data/5K/5KOK-S9T/5KOK-S9T_ligand.pdbqt
data/5K/5KOK-S9T/5KOK-S9T_target.pdbqt
data/5K/5KOK-S9T/5KOK-S9T_decoys.pdbqt
data/5K/5KOK-S9T/5KOK-S9T_decoy_scores.csv