K. N. Houk

Publication Activity (10 Years)

Years Active: 1998-2016
Publications (10 Years): 1

Top Topics

Machine Learning

Agent Architecture

Top Venues

J. Comput. Chem.

Publications

Brian J. Levandowski, Lufeng Zou, K. N. Houk
Schleyer hyperconjugative aromaticity and Diels-Alder reactivity of 5-substituted cyclopentadienes. J. Comput. Chem. 37 (1) (2016)
Chaitanya S. Wannere, Ankan Paul, Rainer Herges, K. N. Houk, Henry F. Schaefer III, Paul von Ragué Schleyer
The existence of secondary orbital interactions. J. Comput. Chem. 28 (1) (2007)
Gregori Ujaque, Dean J. Tantillo, Yunfeng Hu, K. N. Houk, Kinya Hotta, Donald Hilvert
Catalysis on the coastline: Theozyme, molecular dynamics, and free energy perturbation analysis of antibody 21D8 catalysis of the decarboxylation of 5-nitro-3-carboxybenzisoxazole. J. Comput. Chem. 24 (1) (2003)
Dean J. Tantillo, K. N. Houk
Transition state docking: A probe for noncovalent catalysis in biological systems. Application to antibody-catalyzed ester hydrolysis. J. Comput. Chem. 23 (1) (2002)
Sandra Handschuh, Bernd Goldfuss, Jiangang Chen, Johann Gasteiger, K. N. Houk
Steroid binding by antibodies and artificial receptors: Exploration of theoretical methods to determine the origins of binding affinities and specificities. J. Comput. Aided Mol. Des. 14 (7) (2000)
Jiangang Chen, K. N. Houk
Molecular Modeling: Principles and Applications By Andrew R. Leach. Addison Wesley Longman Limited: Essex, England, 1996, 595 pp. ISBN 0-582-23933-8. J. Chem. Inf. Comput. Sci. 38 (5) (1998)