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eLife12d
Cancer cells differentially modulate mitochondrial respiration to alter redox state and enable biomass synthesis in nutrient-limited environments
The cell NAD+/NADH ratio can constrain biomass synthesis and influence proliferation in nutrient-limited environments. However, which cell processes regulate the NAD+/NADH ratio is not known. Here, we ...
C&EN28d
Quaternary Ammonium Salts as Supporting Electrolytes in Cathodic Reductions: An Analysis of Their Electrochemical Stability | The Journal of Physical Chemistry B - ACS Publications
We present a study of the thermodynamic and kinetic electrochemical stability of a test set of more than 5000 singly charged and doubly charged cations containing a quaternary ammonium group. The ...
C&EN21d
The Buffering Activity of Ceria toward Reactive Oxygen Species: A Density Functional Theory Perspective | The Journal of Physical Chemistry C - ACS Publications
(39) Indeed, the presence of surface defect states (SDSs) alone, such as oxygen vacancies and chemisorbed hydrogen is not sufficient to allow the direct electron transfer, as in the computational ...
IEEE14d
Breaking the Million-Electron and 1 EFLOP/s Barriers: Biomolecular-Scale Ab Initio Molecular Dynamics Using MP2 Potentials - IEEE Xplore
The accurate simulation of complex biochemical phenomena has historically been hampered by the computational requirements of high-fidelity molecular-modeling techniques. Quantum mechanical methods, ...