AUTOSTERE: Systematic Search for Scaffold Replacement Opportunities within Structural Databases

Jonathan R. Heal, Joseph M. Sheridan, Manisha Kulkarni, Neill Liptrott, Deirdre Egan, Saye Khoo, Ian Matthews, William D. O. Hamilton. AUTOSTERE: Systematic Search for Scaffold Replacement Opportunities within Structural Databases. Journal of Chemical Information and Computer Sciences, 61(4):1778-1788, 2021. [doi]

Authors

Jonathan R. Heal

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Joseph M. Sheridan

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Manisha Kulkarni

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Neill Liptrott

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Deirdre Egan

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Saye Khoo

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Ian Matthews

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William D. O. Hamilton

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