Practical Fragments

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

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Practicalfragments.blogspot.com news digest

  • 12 days

    Detailing hot spots with atomic consensus sites

    Practical Fragments haswritten frequently about hot spots, regions on proteins that are predisposed tobind ligands such as drugs. Determining whether a protein has a hot spot can helpprioritize a target for screening, and one of the more established...

  • 19 days

    Nineteenth Annual Fragment-Based Drug Discovery Meeting

    Last week the CHI Drug DiscoveryChemistry (DDC) meeting was held in San Diego. This was the largest ever, with morethan 900 participants, 95% of whom attended in person, up from 87% last year. Iwon’t attempt to cover all fourteen tracks but will just...

  • 26 days

    Personality tests for molecules

    Long-time readers of PracticalFragments will be familiar with various metrics for measuring molecules, suchas LE, LLE, and WTF. But these are all hard-edged, numerical constructs.Some folks argue that we should take a softer, more nuanced approach. This...

  • 1 month

    Fragments vs DHODH

    Rapidly proliferating cancer cellsrequire a steady supply of nucleic acids, and cutting that off is a potentialtherapy. The enzyme dihydroorotate dehydrogenase (DHODH), which is important forpyrimidine synthesis, is thus an interesting drug target. In...

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