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Increasing chemical space coverage by combining empirical and computational fragment screens
Published Web Location
http://europepmc.org/articles/PMC4215856?pdf=renderNo data is associated with this publication.
Abstract
Most libraries for fragment-based drug discovery are restricted to 1,000-10,000 compounds, but over 500,000 fragments are commercially available and potentially accessible by virtual screening. Whether this larger set would increase chemotype coverage, and
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