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Frags2Drugs: A Novel In Silico Fragment-Based Approach to the Discovery of Kinase Inhibitors

<b>Background/Objectives</b>: Fragment-based approaches in the field of drug discovery and design have been widely developed and employed in both academia and industry. We present here an innovative in silico fragment-based drug design approach aimed at designing new inhibitors in the ATP-binding si...

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Principais autores: Gautier Peyrat, Colin Bournez, Pascal Krezel, José-Manuel Gally, Stéphane Bourg, Samia Aci-Sèche, Pascal Bonnet
Format: Artigo
Sprog:Inglês
Udgivet: MDPI AG 2026-02-01
Serier:Pharmaceuticals
Fag:
kinase research
fragment growing
fragment-based ligand design (FBLD)
network graph
protein kinase inhibitor
Online adgang:https://www.mdpi.com/1424-8247/19/2/308
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