Practical Fragments

This blog is meant to allow Fragment-based Drug Design Practitioners to get together and discuss NON-CONFIDENTIAL issues regarding fragments.

Showing posts with label Fsp3. Show all posts
Showing posts with label Fsp3. Show all posts
19 January 2026

How best to assess molecular shapeliness?

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The shape of a molecule influences its properties. While this is true on a per-compound level, things get a little more controversial when d...
03 February 2020

Fragments vs RIP2: from flat fragment to shapely selectivity

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Last week we highlighted the utility of shapely fragments. However, as the latest review of fragment-to-lead success stories again shows...
09 December 2019

A new library of fluorinated Fsp3-rich fragments

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Among fragment-finding methods , ligand-based NMR ranks near the top in terms of popularity. Of its many variations, fluorine ( 19 F) NMR...
2 comments:
06 October 2014

Physical properties in drug design

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This is the title of a magisterial review by Rob Young of GlaxoSmithKline in Top. Med. Chem. At 68 pages it is not a quick read, but it d...
12 comments:
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