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Collect. Czech. Chem. Commun. 2007, 72, 153-163
https://doi.org/10.1135/cccc20070153

A Fundamental Relation of Molecular Informatics on the Information-Carrying Properties of Density Functions

Paul G. Mezeya,b

a Canada Research Chair in Scientific Modeling and Simulation, Department of Chemistry and Department of Physics and Physical Oceanography, Memorial University of Newfoundland, St. John's, NL, Canada A1B 3X7
b Institute for Advanced Study, Collegium Budapest, Szentháromság u. 2, H 1014 Budapest, Hungary

Crossref Cited-by Linking

  • Antal Zoltan, Mezey Paul G.: A modified ADMA linear scaling macromolecular method for enhanced detection of induced molecular shape changes. JCM 2019, 19, 219. <https://doi.org/10.3233/JCM-180882>
  • Mezey Paul G., Antal Zoltan: An alternative to the “Star Path” enhancement of the ADMA linear scaling method for protein modeling. J Comput Chem 2017, 38, 1774. <https://doi.org/10.1002/jcc.24817>
  • Mezey Paul G.: Fuzzy Electron Density Fragments in Macromolecular Quantum Chemistry, Combinatorial Quantum Chemistry, Functional Group Analysis, and Shape–Activity Relations. Acc. Chem. Res. 2014, 47, 2821. <https://doi.org/10.1021/ar5001154>