Enzyme engineering by directed evolution and applications in cellular imaging and proteomic mapping by Lam, Stephanie S. (Stephanie Shih-Min)

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The role of weak interactions in lignin polymerization by Sánchez-González, Ángel, Dobado, J. A., Martin-Martinez, Francisco J.

“…Quantum theory of atoms in molecules (QTAIM) has been applied to understand the coupling reaction mechanisms, for which the radical species and transition states (TSs) involved have been characterized. …”
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Linking microbial metabolism and organic matter cycling through metabolite distributions in the ocean by Johnson, Winifred M., Ph. D. Massachusetts Institute of Technology

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Molecular design interactions : material synthesis for human interaction with fluids by Kan, Viirj

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Mechanisms of discharge product evolution and solvent stability in lithium-oxygen batteries by Batcho, Thomas Peter

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CMOS nanofluidics by Meng, Huaiyu

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Simulating exciton dynamics in organic semiconductors by Lee, Chee Kong,Ph. D.Massachusetts Institute of Technology.

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Laboratory studies of the multiday oxidative aging of atmospheric organic aerosol by Lim, Christopher Y.(Christopher Yung-Ta)

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Estimates for solutions to the Dysthe equation and numerical simulations of walking droplets in harmonic potentials by Kurianski, Kristin Marie-Dettmers.

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Engineering of Saccharomyces cerevisiae for renewable production of plastic precursor chemicals from plant biomass by Uranukul, Boonsom.

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Methodologies for the mechanistic study of compartment-specific hydrogen peroxide perturbations by Stein, Kassi Taylor.

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Self-Evolving Machine: A Continuously Improving Model for Molecular Thermochemistry by Li, Yi-Pei, Han, Kehang, Grambow, Colin A., Green Jr, William H

“…Keyword: Physical and theoretical chemistry; Thermodynamic modeling; Molecular modeling; Molecules; Thermochemistry enthalpy…”
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Triplet Tuning: A Novel Family of Non-Empirical Exchange–Correlation Functionals by Lin, Zhou, Van Voorhis, Troy

“…Phys. 2009, 130, 054112] and tested on four sets of large organic molecules. Compared to existing functionals, TT-ωPBEh manages to provide more accurate predictions for key spectroscopic and photochemical observables, including but not limited to E T , the optical band gap (E S ), the singlet-triplet gap (ΔE ST ), and the vertical ionization potential, as it adjusts the effective electron-hole interactions to arrive at the correct excitation energies. …”
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Pressure-dependent kinetics of peroxy radicals formed in isobutanol combustion by Goldman, Mark Jacob, Yee, Nathan Wa-Wai, Kroll, Jesse, Green Jr, William H

“…This work examines 47 molecules and 38 reactions involved in the first oxygen addition to isobutanol's three alkyl radicals located α, β, and γ to the hydroxide. …”
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Enhanced light-atom interaction in an optical resonator by Duan, Yiheng.

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Investigating the ice nucleation activity of organic aerosol by Wolf, Martin Johann.

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Development of colloidal quantum dot and lead halide perovskite light emitting devices by Xie, Sihan,Ph. D.Massachusetts Institute of Technology.

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Extracellular Reef Metabolites Across the Protected Jardines de la Reina, Cuba Reef System by Weber, Laura, Armenteros, Maickel, Kido Soule, Melissa, Longnecker, Krista, Kujawinski, Elizabeth B., Apprill, Amy

“…Understanding the composition of extracellular reef metabolites in seawater, the small organic molecules that serve as the currency for microorganisms, may provide insight into benthic-pelagic coupling as well as the complexity of nutrient cycling in coral reef ecosystems. …”
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Distributed implementation of Boolean functions by transcriptional synthetic circuits by Al-Radhawi, M Ali, Tran, Anh Phong, Ernst, Elizabeth A, Chen, Tianchi, Voigt, Christopher A, Sontag, Eduardo D

“…A possible way around this scalability problem is to distribute the computation among multiple cell types, each of which implements a small subcircuit, which communicate among themselves using diffusible small molecules (DSMs). Examples of DSMs are those employed by quorum sensing systems in bacteria. …”
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Precision measurement of the electron energy-loss function in tritium and deuterium gas for the KATRIN experiment by Aker, M., Beglarian, A., Behrens, J., Berlev, A., Besserer, U., Bieringer, B., Block, F., Bornschein, B., Bornschein, L., Böttcher, M., Brunst, T., Caldwell, T. S., Carney, R. M. D., Chilingaryan, S., Choi, W., Debowski, K., Deffert, M., Descher, M., Barrero, D. D., Doe, P. J.

“…A dominant systematic effect of the response of the experimental setup is the energy loss of $$\upbeta $$ β -electrons from elastic and inelastic scattering off tritium molecules within the source. We determined the energy-loss function in-situ with a pulsed angular-selective and monoenergetic photoelectron source at various tritium-source densities. …”
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