Computational Chemistry, Molecular Complexity and Screening Set Design

Computational Chemistry, Molecular Complexity and Screening Set Design 

Michael M. Hann, Andrew R. Leach, and Darren V.S. Green 

Background Concepts the Virtual, Tangible and Real Worlds of Compounds, the Knowledge Plot and Target Tractablllty 

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Hann MM, Leach AR, Green DVS. Computational chemistry, molecular complexity and screening set design. In Oprea TI, editor, Chemoinformatics in drug discovery, Weinheim, Wiley-VCH, 2004 43-57. 

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