Using the Theozyme Model to Study the Dynamical Mechanism of the Post-Transition State Bifurcation Reaction by NgnD Enzyme by Yaning Hou, Jingyun Chen, Weizhe Liu, Gaohua Zhu, Qianying Yang, Xin Wang

Subjects: “…post-transition state bifurcation…”
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DFT study of condensation mechanisms of 4-pyridinecarboxaldehyde with o-, m-, p-aminobenzoic acids by Ion Arsene, Eduard Coropceanu, Viorica Purcel

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Mechanism and reaction kinetics analysis of small-molecule gas formation during thermal decomposition of hydroxylamine nitrate by Men Li, Tianpeng Li, Xinbao Gao

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First-Principles Study of Titanium-Doped B₇ Cluster for High Capacity Hydrogen Storage by Haishen Huang, Guoxu Li, Zhenqiang Li, Tingyan Zhou, Ping Li, Xiude Yang, Bo Wu

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Studies of axially chiral atropisomers of an indole-substituted phthalonitrile derivative by Ayari, Sami, Elleuch, Haitham, Thebti, Amal, Ouzari, Hadda-Imene

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Quantum Mechanics/Molecular Mechanics Simulations for Chiral-Selective Aminoacylation: Unraveling the Nature of Life by Tadashi Ando, Koji Tamura

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A Transition State Theory-Based Continuum Plasticity Model Accounting for the Local Stress Fluctuation by Yongjia Zheng, Hongwei Wang, Xiangyu Zhou, Ding Tang, Huamiao Wang, Guoliang Wang, Peidong Wu, Yinghong Peng, Yaodong Jiang

Subjects: “…transition state theory…”
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Reliable methods to determine experimental energy barriers for transport in salt-rejecting membranes by Mohammad Allouzi, Mor Avidar, Liat Birnhack, Razi Epsztein, Anthony P. Straub

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Kinetic Isotope Effect in the Unfolding of a Protein Secondary Structure: Calculations for Beta-Sheet Polyglycine Dimers as a Model by Alexey O. Yanshin, Vitaly G. Kiselev, Alexey V. Baklanov

Subjects: “…completely loose transition state…”
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Efficient direct asymmetric aldol reactions in water using chiral diamide as organocatalysts by Benrzeil Hajar, Tazi Bouchra, Guenoun Farhate

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Ethanol properties effects on its reaction with Mo-doped SnO2 clusters: A gas sensor model by Mudar Ahmed Abdulsattar, Rashid Hashim Jabbar, Mohammed A. Al-Seady

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PREDICTING THE LEARNING PATH TO LEARNER’S OPTIMUM COMPREHENSION by Ifeanyi Isaiah Achi, Chukwuemeka Odi Agwu, Christopher Chizoba Nnamene, Sylvester C. Aniobi, Ifebude Barnabas C., Kelechi Christian Oketa, Godson Kenechukwu Ezeh, John Otozi Ugah

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