Opportunity Knocks: Organic Chemistry for Fragment-Based Drug Discovery (FBDD)

2015 ◽  
Vol 55 (2) ◽  
pp. 488-492 ◽  
Author(s):  
Christopher W. Murray ◽  
David C. Rees
Keyword(s):  
Organic Chemistry ◽  
Drug Discovery ◽  
Fragment Based Drug Discovery

scholarly journals Fragment-based drug discovery: opportunities for organic synthesis

2021 ◽  
Author(s):  
Jeffrey D. St. Denis ◽  
Richard J. Hall ◽  
Christopher W. Murray ◽  
Tom D. Heightman ◽  
David C. Rees
Keyword(s):  
Organic Chemistry ◽  
Drug Discovery ◽  
Organic Synthesis ◽  
Fragment Based Drug Discovery

Herein is described the concept of fragment sociability and the opportunities for organic chemistry to address the challenges of fragment elaboration.

Data augmentation and transfer learning strategies for reaction prediction in low chemical data regimes

2021 ◽  
Author(s):  
Yun Zhang ◽  
Ling Wang ◽  
Xinqiao Wang ◽  
Chengyun Zhang ◽  
Jiamin Ge ◽  
...  
Keyword(s):  
Organic Chemistry ◽  
Deep Learning ◽  
Drug Discovery ◽  
Research And Development ◽  
Learning Strategies ◽  
Transfer Learning ◽  
Chemical Reactions ◽  
Data Augmentation ◽  
Learning Method ◽  
Reaction Prediction

An effective and rapid deep learning method to predict chemical reactions contributes to the research and development of organic chemistry and drug discovery.

scholarly journals Validating Fragment-Based Drug Discovery for Biological RNAs: Lead Fragments Bind and Remodel the TPP Riboswitch Specifically

2014 ◽  
Vol 21 (5) ◽  
pp. 591-595 ◽  
Author(s):  
Katherine Deigan Warner ◽  
Philip Homan ◽  
Kevin M. Weeks ◽  
Alison G. Smith ◽  
Chris Abell ◽  
...  
Keyword(s):  
Drug Discovery ◽  
Fragment Based Drug Discovery
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