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Alex performed some computational work in support of an excellent experimental contribution from the Lundgren group. The paper “Z-Selective Iridium-Catalyzed Cross-Coupling of Allylic Carbonates and α-Diazo Esters” was recently accepted in Chemical Science.

  Category: Publications

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October 31st, 2017

Alex’s first collaborative work with Lundgren group accepted in Chem. Sci.

Alex performed some computational work in support of an excellent experimental contribution from the Lundgren group. The paper “Z-Selective Iridium-Catalyzed […]

September 19th, 2017

Congratulations to Inara on paper accepted in ACS-AMI

Congratulations to Inara de Aguiar (post-doc co-supervised with Prof. Gabriel Cruz e Souza, UFMT, Brazil) on her paper accepted in […]

August 5th, 2017

Congratulations to Ekadashi on publication of his HONO PES paper in PCCP

Ekadashi’s paper entitled “A Ground State Potential Energy Surface for HONO based on a Neural Network with Exponential Fitting Functions” […]

June 14th, 2017

Paper with Rivard and Müller-Buschbaum groups makes cover of MRC

Alex’s collaborative paper with the Rivard (Alberta) and the Müller-Buschbaum (Munich) research groups is published in and makes the cover of Macromolecular Rapid […]

June 3rd, 2017

Alex and Ekadashi’s review accepted into JTCC

Alex and Ekadashi’s review “Fitting potential energy surfaces to sum-of-products form with neural networks using exponential neurons” is accepted for […]

February 28th, 2017

Alex’s paper with Rivard and Müller-Buschbaum groups accepted for publication

Alex’s collaborative paper with the Rivard (Alberta) and the Müller-Buschbaum (Munich) research groups has been accepted for publication in Macromolecular Rapid […]

December 10th, 2016

Congratulations to Shuai on publication of his paper

The final chapter of Shuai’s thesis “Effects of Hydrogen Bonding with H2O on the Resonance Raman Spectra of Uracil and […]

November 1st, 2016

Mohammed S.’s paper with Campbell group accepted into ChemBioChem

Mohammad S. contributed some nice computational interpretation to the paper “A tandem green-red heterodimeric fluorescent protein with high FRET efficiency” […]

October 13th, 2016

Congratulations to Mohammad M. on sole author paper in JCTC

Congratulations to Mohammad M. for his sole author paper “Intramolecular Singlet Fission in Quinoidal Bi- and Tetrathiophenes: A Comparative Study […]

August 9th, 2016

Mohammad and Isaac’s paper accepted into PCCP

Congratulations to Mohammad and Isaac whose paper “Prediction of two-photon absorption enhancement in red fluorescent protein chromophores made from non-canonical […]