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 - Archive ouverte HAL Accéder directement au contenu
Article Dans Une Revue Journal of Biomolecular Structure and Dynamics Année : 2022

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

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hal-04157330 , version 1 (10-07-2023)

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Nour-El-Houda Hammoudi, Yacine Benguerba, Ayoub Attoui, Cecilia Hognon, Tarek Lemaoui, et al.. 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, 40 (2), pp.886-902. ⟨10.1080/07391102.2020.1819878⟩. ⟨hal-04157330⟩
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