M Congreve, G Chessari, D Tisi… - Journal of medicinal …, 2008 - ACS Publications
The field of fragment-based drug discovery (FBDDa) has developed significantly over the past 10 years and is now recognized as a tangible alternative to more traditional methods of …
B Over, S Wetzel, C Grütter, Y Nakai, S Renner… - Nature …, 2013 - nature.com
Fragment-based ligand and drug discovery predominantly employs sp 2-rich compounds covering well-explored regions of chemical space. Despite the ease with which such …
The pandemic prevalence of COVID-19 has become a very serious global health issue. Scientists all over the world have been seriously attempting in the discovery of a drug to …
Y Chen, BK Shoichet - Nature chemical biology, 2009 - nature.com
Fragment screens have successfully identified new scaffolds in drug discovery, often with relatively high hit rates (5%) using small screening libraries (1,000–10,000 compounds) …
A Kumar, A Voet, KYJ Zhang - Current medicinal chemistry, 2012 - ingentaconnect.com
Fragment based drug design has emerged as an effective alternative to high throughput screening for the identification of lead compounds in drug discovery in the past fifteen years …
Accurate and efficient prediction of protein-ligand interactions has been a long-lasting dream of practitioners in drug discovery. The insufficient treatment of hydration is widely …
Y Bian, XQ Xie - The AAPS journal, 2018 - Springer
Fragment-based drug design (FBDD) has become an effective methodology for drug development for decades. Successful applications of this strategy brought both opportunities …
MN Schulz, RE Hubbard - Current opinion in pharmacology, 2009 - Elsevier
Fragment-based methods have emerged as a new strategy for drug discovery. The main advantages are that useful starting points for lead identification for most targets can be …
RE Hubbard, JB Murray - Methods in enzymology, 2011 - Elsevier
This chapter summarizes the experience at Vernalis over the past decade in developing and applying fragment-based discovery methods across a range of different targets. The …