Results 231 to 240 of about 27,071 (245)

In silico drug discovery of IKK-β inhibitors from 2-amino-3-cyano-4-alkyl-6-(2-hydroxyphenyl) pyridine derivatives based on QSAR, docking, molecular dynamics and drug-likeness evaluation studies

Journal of Biomolecular Structure and Dynamics, 2022
Yacine Benguerba, Cécilia Hognon, Tarek Lemaoui   +2 more
exaly  

DFT analysis and in silico exploration of drug-likeness, toxicity prediction, bioactivity score, and chemical reactivity properties of the urolithins

Journal of Biomolecular Structure and Dynamics, 2023
Yousif Taha Hussein, Yousif Hussein Azeez   +1 more
exaly  

A drug-likeness toolbox facilitates ADMET study in drug discovery

Drug Discovery Today, 2020
Ge-Fei Hao, Guang-Fu Yang
exaly  

Chalcones as Promising Antitumor Agents by Targeting the p53 Pathway: An Overview and New Insights in Drug-Likeness

Molecules, 2021
Joana Moreira, Joana Filipa D Almeida, Lucília Saraiva   +2 more
exaly  

Fsp3: A new parameter for drug-likeness

Drug Discovery Today, 2020
Wenxiu Wei, Srinivasulu cherukupalli, Xinyong Liu   +2 more
exaly  

Do Drug‐likeness Rules Apply to Oral Prodrugs?

ChemMedChem, 2021
Vinícius Gonçalves Maltarollo, Renata Barbosa de Oliveira   +1 more
exaly  

Implications of endogenous roles of transporters for drug discovery: hitchhiking and metabolite-likeness

Nature Reviews Drug Discovery, 2016
Douglas Kell
exaly  

The application of in silico drug-likeness predictions in pharmaceutical research

Advanced Drug Delivery Reviews, 2015
Sheng Tian, Junmei Wang, Youyong Li
exaly  

Understanding drug‐likeness

Wiley Interdisciplinary Reviews: Computational Molecular Science, 2011
Oleg Ursu, Anwar Rayan, Amiram Goldblum
exaly  

Drug-likeness Analysis of Traditional Chinese Medicines: Prediction of Drug-likeness Using Machine Learning Approaches

Molecular Pharmaceutics, 2012
Sheng Tian, Junmei Wang, Youyong Li
exaly