To meet the growing demands across various application fields, there is an urgent need to develop phosphorescent iridium(III) complex luminescent materials that combine high luminous efficiency with p

NIAID Data Ecosystem30

Adsorption, distribution, metabolism, toxicity properties and predicted pIC 50 of Saracatinib and the top three TCM compounds.

药物ADMET

化合物筛选

*Control. 1ADMET Adsorption levels: 0 = Good; 1 = Moderate; 2 = Low; 3 = Very low. 2Plasma Protein Binding: 0 = Binding 90%; 2 = Binding >95%. 3Inhibition probability of Cytochrome

NIAID Data Ecosystem10

SAVI-Space

虚拟筛选化合物库

药物发现

This dataset was published as part of SAVI Space—combinatorial encoding of the billion-size synthetically accessible virtual inventory (Korn, M., Judson, P., Klein, R. et...

B2FIND30

Virtual screening of the Enamine REAL database against SARS-CoV-2 RdRP

抗病毒药物

虚拟筛选化合物库

This short report describes the most relevant results of virtually screening the Enamine REAL database for potential activity against SARS-CoV-2 RdRP and confirmation of potential hits in a VeroE6 cel

Zenodo2022-01-11 更新20

ADMET Profile of Selected DHPS Virtual Screening Hits and Analogues.

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