Molecular similarity - PowerPoint PPT Presentation

Similarity and Diversity Alexandre Varnek, University of Strasbourg, France

Similarity and Diversity Alexandre Varnek, University of Strasbourg, France. What is similar?. Colour. Shape. Pattern. Size. Different „spaces“, classified by:. 16 diverse aldehydes. ...sorted by common scaffold. ...sorted by functional groups. The „Similarity Principle“ :

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Ajay N. Jain

Surflex: Fully Automatic Flexible Molecular Docking Using a Molecular Similarity-Based Search Engine. Ajay N. Jain UCSF Cancer Research Institute and Comprehensive Cancer Center, University of California Presentation by Susan Tang CS 379a January 23, 2006.

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