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Hot spot analysis for driving the development of hits into leads in fragment based drug discovery

Fragment based drug design (FBDD) starts with finding fragment-sized compounds that are highly ligand efficient and can serve as a core moiety for developing high affinity leads. Although the core-bound structure of a protein facilitates the construction of leads, effective design is far from straig...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Hauptverfasser: Hall, David R., Ngan, Chi Ho, Zerbe, Brandon S., Kozakov, Dima, Vajda, Sandor
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2011
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3264775/
https://ncbi.nlm.nih.gov/pubmed/22145575
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/ci200468p
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