Benchmark Study on the Smallest Bimolecular Nucleophilic Substitution Reaction: H−+CH4 →CH4+H−

by Marcel Swart, F. Matthias Bickelhaupt
Published 2013-07-01

Arylic C–X Bond Activation by Palladium Catalysts: Activation Strain Analyses of Reactivity Trends

by Pascal Vermeeren, Xiaobo Sun, F. Matthias Bickelhaupt
Published 2018-07-01

Switch From Pauli‐Lowering to LUMO‐Lowering Catalysis in Brønsted Acid‐Catalyzed Aza‐Diels‐Alder Reactions

by Song Yu, Prof. Dr. F. Matthias Bickelhaupt, Dr. Trevor A. Hamlin
Published 2021-08-01

Supramolecular Ring Structures of 7-Methylguanine: A Computational Study of Its Self-assembly and Anion Binding

by Lajos Kovács, F. Matthias Bickelhaupt, Célia Fonseca Guerra, Zoltán Kupihár, Gábor Paragi
Published 2012-12-01

Special Collection: Computational Chemistry

by Prof. Dr. Miquel Solà, Prof. Dr. Frank De Proft, Prof. Dr. F. Matthias Bickelhaupt
Published 2019-07-01

Hydride affinities of cationic maingroup-element hydrides across the periodic table

by Eva Blokker, Caroline G.T. Groen, J. Martijn van der Schuur, Auke G. Talma, F. Matthias Bickelhaupt
Published 2019-01-01

A Quantitative Molecular Orbital Perspective of the Chalcogen Bond

by Lucas deAzevedo Santos, Dr. Stephanie C. C. van derLubbe, Dr. Trevor A. Hamlin, Teodorico C. Ramalho, Prof. Dr. F. Matthias Bickelhaupt
Published 2021-04-01

A Quantitative Molecular Orbital Perspective of the Chalcogen Bond

by Lucas deAzevedo Santos, Dr. Stephanie C. C. van derLubbe, Dr. Trevor A. Hamlin, Teodorico C. Ramalho, Prof. Dr. F. Matthias Bickelhaupt
Published 2021-04-01

Comparison of Molecular Recognition of Trimethyllysine and Trimethylthialysine by Epigenetic Reader Proteins

by Jordi C. J. Hintzen, Jordi Poater, Kiran Kumar, Abbas H. K. Al Temimi, Bas J. G. E. Pieters, Robert S. Paton, F. Matthias Bickelhaupt, Jasmin Mecinović
Published 2020-04-01