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Inhibition of Amyloid Nucleation by Steric Hindrance
The Journal of Physical Chemistry B, 2022Despite recent experiments and simulations suggesting that small-molecule inhibitors and some post-translational modifications (e.g., glycosylation and ubiquitination) can suppress the pathogenic aggregation of proteins due to steric hindrance, the effect of steric hindrance on amyloid formation has not been systematically studied. Based on Monte Carlo
Kai Wu +4 more
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Calculation of Steric Hindrance
Nature, 1942IT seems possible to account for the steric effect of non-reacting groups on substitution rates on the lines of the following scheme, illustrated here by the example of the symmetrical substitution of t-butyl chloride by chlorine ions: In the transition state, the four t-butyl carbons will be co-planar and the methyl groups will cause least obstruction
A. G. EVANS, M. POLANYI
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Journal of Physical Chemistry Letters, 2022
Most high-performance non-fullerene acceptors are of the acceptor-donor-acceptor (A-D-A)-type structure. Under photoexcitation, the intramolecular charge transfer effect on the A-D-A framework results in a large dipole moment change, facilitating the ...
Guangliu Ran +7 more
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Most high-performance non-fullerene acceptors are of the acceptor-donor-acceptor (A-D-A)-type structure. Under photoexcitation, the intramolecular charge transfer effect on the A-D-A framework results in a large dipole moment change, facilitating the ...
Guangliu Ran +7 more
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Quantum Mechanical Size and Steric Hindrance
The Journal of Physical Chemistry A, 2006A quantum mechanical definition of molecular size and shape is formulated from the electronic second moment of the Hartree-Fock wave function. The shape tensor is defined to be invariant with respect to the origin. The geometric average of the eigenvalues of the tensor correlates very well with van der Waals and Bragg-Slater radii.
Joshua W, Hollett +2 more
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Angewandte Chemie, 2022
A ferrocene surfactant can be switched between single and double head form (FcN+C12/Fc+N+C12) triggered by redox reactions. FcN+C12 can neither stabilize an O/W emulsion alone nor an oil-in-dispersion emulsion in combination with alumina nanoparticles ...
Yunshan Liu +5 more
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A ferrocene surfactant can be switched between single and double head form (FcN+C12/Fc+N+C12) triggered by redox reactions. FcN+C12 can neither stabilize an O/W emulsion alone nor an oil-in-dispersion emulsion in combination with alumina nanoparticles ...
Yunshan Liu +5 more
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Advanced Functional Materials, 2021
The design of photosensitizers (PSs) with fluorescence in the second near‐infrared (NIR‐II, 1000–1700 nm) window remains a challenge, as the introduction of donor or acceptor units with excessively strong electron‐withdrawing or donating ability leads to
Shuai Gao +8 more
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The design of photosensitizers (PSs) with fluorescence in the second near‐infrared (NIR‐II, 1000–1700 nm) window remains a challenge, as the introduction of donor or acceptor units with excessively strong electron‐withdrawing or donating ability leads to
Shuai Gao +8 more
semanticscholar +1 more source
Steric hindrance of acetophosphides
Bulletin of the Academy of Sciences of the USSR Division of Chemical Science, 19681. The introduction of a bulky substituent at the carbonyl group in acetophosphides invokes steric hindrance to the existence of the cis isomer. 2. The low-frequency peak νCO in the IR spectra of acetophosphides is due to the trans isomer.
R. G. Kostyanovskii +3 more
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Solar RRL, 2022
The efficiency and stability of perovskite solar cells (PSCs) can be effectively improved by interfacial modification with butylammonium iodide (BAI). However, the steric hindrance of BAI is not explored.
Xusheng Zhao +8 more
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The efficiency and stability of perovskite solar cells (PSCs) can be effectively improved by interfacial modification with butylammonium iodide (BAI). However, the steric hindrance of BAI is not explored.
Xusheng Zhao +8 more
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Advanced Energy Materials
The electrode/electrolyte interfacial side reaction is a critical issue for aqueous zinc ion batteries (ZIBs). In this study, it presents an innovative electrolyte designed to utilize steric hindrance effects to modulate Zn ion deposition behavior while ...
Yuao Wang +6 more
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The electrode/electrolyte interfacial side reaction is a critical issue for aqueous zinc ion batteries (ZIBs). In this study, it presents an innovative electrolyte designed to utilize steric hindrance effects to modulate Zn ion deposition behavior while ...
Yuao Wang +6 more
semanticscholar +1 more source
Steric-hindrance Effect Tuned Ion Solvation Enabling High Performance Aqueous Zinc Ion Batteries.
Angewandte ChemieDespite many additives have been reported for aqueous zinc ion batteries, steric- hindrance effect of additives and its correlation with Zn2+ solvation structure have been rarely reported. Herein, large-sized sucrose biomolecule is selected as a paradigm
Haozhen Dou +8 more
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