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Overview of the perspectives devoted to tautomerism in molecular design

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Abstract

This communication summarizes the important points made in each contribution. They show that there remain issues in the cheminformatic handling of tautomers and predicting the relative energies of various tautomers.

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References

  1. Milletti F, Storchi L, Sforna G, Cross S, Cruciani G (2009) J Chem Inf Model 49:68–75

    Article  CAS  Google Scholar 

  2. ten Brink T, Exner TE (2009) J Chem Inf Model 49:1535–1546

    Article  CAS  Google Scholar 

  3. http://www.chemaxon.com/marvin/help/chemicalterms/EvaluatorFunctions.html#isomers_functions

  4. http://www.molecular-networks.com/files/docs/tautomer/

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Correspondence to Yvonne Connolly Martin.

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Martin, Y.C. Overview of the perspectives devoted to tautomerism in molecular design. J Comput Aided Mol Des 24, 473–474 (2010). https://doi.org/10.1007/s10822-010-9357-1

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  • DOI: https://doi.org/10.1007/s10822-010-9357-1

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