Multicomponent orbital-optimized perturbation theory methods: Approaching coupled cluster accuracy at lower cost F Pavošević, BJG Rousseau, S Hammes-Schiffer The Journal of Physical Chemistry Letters 11 (4), 1578-1583, 2020 | 40 | 2020 |
Charge transfer between [4Fe4S] proteins and DNA is unidirectional: Implications for biomolecular signaling RD Teo, BJG Rousseau, ER Smithwick, R Di Felice, DN Beratan, ... Chem 5 (1), 122-137, 2019 | 38 | 2019 |
Determinants of Photolyase’s DNA Repair Mechanism in Mesophiles and Extremophiles BJG Rousseau, S Shafei, A Migliore, RJ Stanley, DN Beratan Journal of the American Chemical Society 140 (8), 2853-2861, 2018 | 21 | 2018 |
Proton-regulated alcohol oxidation for high-capacity ketone-based flow battery anolyte R Feng, Y Chen, X Zhang, BJG Rousseau, P Gao, P Chen, ... Joule 7 (7), 1609-1622, 2023 | 4 | 2023 |
Computational Insights into the Mechanism of Nitric Oxide Generation from S-Nitrosoglutathione Catalyzed by a Copper Metal–Organic Framework BJG Rousseau, AV Soudackov, RR Tuttle, MM Reynolds, RG Finke, ... Journal of the American Chemical Society 145 (18), 10285-10294, 2023 | 4 | 2023 |
Viewpoints on the 2020 Virtual Conference on Theoretical Chemistry RJ DiRisio, CM Jones, H Ma, BJG Rousseau The Journal of Physical Chemistry A, 2020 | 3 | 2020 |
Adenine Fine-Tunes DNA Photolyase’s Repair Mechanism BJG Rousseau, A Migliore, RJ Stanley, DN Beratan The Journal of Physical Chemistry B 127 (13), 2941-2954, 2023 | | 2023 |
Correction: Charge Transfer between [4Fe4S] Proteins and DNA Is Unidirectional: Implications for Biomolecular Signaling RD Teo, BJG Rousseau, ER Smithwick, R Di Felice, DN Beratan, ... Chem, 1682, 2019 | | 2019 |
Multicomponent Orbital-Optimized Perturbation Theory Methods F Pavoševic, BJG Rousseau, S Hammes-Schiffer | | |