AZT DIPHOSPHATE BINDING TO NUCLEOSIDE DIPHOSPHATE KINASE
收藏NIAID Data Ecosystem2026-05-01 收录
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AZT DIPHOSPHATE BINDING TO NUCLEOSIDE DIPHOSPHATE KINASE
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创建时间：
2024-02-14
相关数据集
MOESM1 of Old drug repositioning and new drug discovery through similarity learning from drug-target joint feature spaces
Additional file 1 Unobserved drug-target pairs with their inference scores (ranked in the ascending order).
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Drug-target affinity predictions data for evaluation of interaction concordance index
This record contains data for repeating the results presented in "Interaction Concordance Index: Performance Evaluation for Interaction Prediction Methods". It contains ground-truth drug–target affini
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MM-GBSA binding energy calculation of bonded and non-bonded interactions of CID_5280445 with 1z8r after every 10 ns from MD Simulation trajectories.
MM-GBSA binding energy calculation of bonded and non-bonded interactions of CID_5280445 with 1z8r after every 10 ns from MD Simulation trajectories.
Figshare2023-08-30 更新20
Contact residues for the eight selected small molecules. All residues contain are within 4 Å of a ligand atom. Residues in bold are common to all six ligands.
Contact residues for the eight selected small molecules. All residues contain are within 4 Å of a ligand atom. Residues in bold are common to all six ligands.
Figshare2015-12-02 更新50
additional data
df.parquet.gzip is processed raw data. This has some genes but is not fully overwrapped with training/test data drug2actions.csv is processd data that has information about drugs' effectiveness. drug2
Zenodo2023-11-09 更新30
