In this blog I will catalog various examples of how to get started with molecular modeling and how to use it in chemical education.
The title of the blog reflects that of a book I am working on and that will be published by CRC press in 2010.
Posts
Density Functional Theory Surrogate Enables Fast and Broad Computational
Evaluation of Homogeneous Transition Metal Catalytic Energy Landscapes
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Kevin P. Quirion, Wang-Yeuk Kong, Britton Stanley, Jyothish Joy, and Daniel
H. Ess (2026)
Highlighted by Jan Jensen
It has been about 10 months since Met...
1 week ago
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