October 2024 - Page 11 of 18

Monitoring electrode/electrolyte interfaces of Li-ion batteries {under|below|beneath} {working|operating|functioning} {conditions|circumstances|situations}: A surface-enhanced Raman spectroscopic study on LiCoO2 composite cathodes

Chemexpress October 14, 2024 0 Comments

Lithium-ion batteries are {commonly|generally|typically|frequently|normally|usually} {used|utilized|employed|utilised|applied|made use of} for electrical {energy|power} storage in {portable|transportable} devices and are promising systems for large-scale {energy|power} storage. {However|Nevertheless|Nonetheless|Even so|On the other hand|Having said that}, their…

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Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes

Chemexpress October 14, 2024 0 Comments

{Despite|Regardless of|In spite of} the {enormous|huge|massive} developments of asymmetric catalysis, the basis for asymmetric induction is largely {limited|restricted} to spatial interaction {between|in between|among|amongst|involving} substrate and catalyst. Consequently, asymmetric discrimination {between|in…

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Atomistic molecular dynamics insights on water {local|nearby|neighborhood|regional} structure and dynamics on {different|various|distinct|diverse|unique|distinctive} surfaces of zeolitic-imidazolate frameworks

Chemexpress October 13, 2024 0 Comments

{Most of|The majority of} chemistry in nanoporous {materials|supplies|components} with {small|little|tiny|modest|smaller|compact} pore sizes and windows is {known|recognized|identified} to {occur|happen|take place} {on the|around the} surface {which is|that is|which can be} in {immediate|instant|quick}…

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Transferrable Selectivity Profiles {Enable|Allow} Prediction in Synergistic Catalyst Space

Chemexpress October 13, 2024 0 Comments

Organometallic intermediates {participate in|take part in} {many|numerous|several|a lot of|quite a few|lots of} multi-catalytic enantioselective transformations directed by a chiral catalyst, {but the|however the} requirement of optimizing two catalyst {components|elements} {is…

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Proton Relay Network in P450cam is Formed Upon Docking of its Redox {Partner|Companion} Putidaredoxin (Pdx)

Chemexpress October 13, 2024 0 Comments

Cytochromes P450 are versatile heme-based enzymes {responsible for|accountable for} {vital|important|essential|crucial|very important} life processes. {Of these|Of those}, P450cam (substrate camphor) has been most studied. {Despite|Regardless of|In spite of} this, precise mechanisms…

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Facile synthesis of biomass-based carbon {materials|supplies|components} nano-Ni-based catalysts and its application in selective hydrogenation of alkynes

Chemexpress October 13, 2024 0 Comments

The {development|improvement} of {high|higher} efficiency, {excellent|superb|outstanding|exceptional|great|fantastic} selectivity, and super activity metal catalyst for chemical selective hydrogenation of alkynes to olefin is of {great|fantastic|excellent|wonderful|good|terrific} significance {in the|within the|inside the} field {of…

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Size dependent inhibition of sperm motility bycopper particles as a path towards reversiblemale contraception

Chemexpress October 13, 2024 0 Comments

{Effective|Efficient|Successful|Powerful|Productive|Helpful} inhibition of sperm motility {using|utilizing|making use of|employing|working with|applying} a spermicide {can be|may be|could be|might be|is often|is usually} a promising {approach|method|strategy} in {developing|creating|building|establishing} non-invasive male contraceptive agents. Copper is {known|recognized|identified}…

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An {Efficient|Effective} GaMD Multi-Level EnhancedSampling {Strategy|Technique|Method|Approach|Tactic}: Application to PolarizableForce Fields Simulations of {Large|Big|Huge|Massive|Substantial|Significant} BiologicalSystems

Chemexpress October 13, 2024 0 Comments

We introduce a novel multi-level enhanced sampling {strategy|technique|method|approach|tactic} grounded on Gaussian accelerated Molecular Dynamics (GaMD). {First|Initial|Very first|1st|Initially}, we propose a GaMD multi-GPUs-accelerated implementation {within the|inside the} Tinker-HP molecular dynamics package.…

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Hydrodeoxygenation of Guaiacol {Over|More than} Orthorhombic Molybdenum Carbide: A DFT and Microkinetic Study

Chemexpress October 12, 2024 0 Comments

The hydrodeoxygenation of guaiacol is modelled {over|more than} a ({100|one hundred}) β-Mo2C surface {using|utilizing|making use of|employing|working with|applying} density functional theory and microkinetic simulations. The thermochemistry {of the|from the|in the|on the|with…

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Electrophilic Sulfur Reagent {Design|Style|Design and style} Enables Catalytic syn-Carbosulfenylation of Unactivated Alkenes

Chemexpress October 12, 2024 0 Comments

A multi-component {approach|method|strategy} to structurally {complex|complicated} organosulfur {products|goods|items|merchandise|solutions} is described {via|by way of|through|by means of} the nickel-catalyzed 1,2-carbosulfenylation of unactivated alkenes with organoboron nucleophiles and tailored organosulfur electrophiles. {Key|Important|Crucial|Essential} {to…

Monitoring electrode/electrolyte interfaces of Li-ion batteries {under|below|beneath} {working|operating|functioning} {conditions|circumstances|situations}: A surface-enhanced Raman spectroscopic study on LiCoO2 composite cathodes

Organocatalytic Discrimination of Non-Directing Aryl and Heteroaryl Groups: Enantioselective Synthesis of Bioactive Indole-Containing Triarylmethanes

Atomistic molecular dynamics insights on water {local|nearby|neighborhood|regional} structure and dynamics on {different|various|distinct|diverse|unique|distinctive} surfaces of zeolitic-imidazolate frameworks

Transferrable Selectivity Profiles {Enable|Allow} Prediction in Synergistic Catalyst Space

Proton Relay Network in P450cam is Formed Upon Docking of its Redox {Partner|Companion} Putidaredoxin (Pdx)

Facile synthesis of biomass-based carbon {materials|supplies|components} nano-Ni-based catalysts and its application in selective hydrogenation of alkynes

Size dependent inhibition of sperm motility bycopper particles as a path towards reversiblemale contraception

An {Efficient|Effective} GaMD Multi-Level EnhancedSampling {Strategy|Technique|Method|Approach|Tactic}: Application to PolarizableForce Fields Simulations of {Large|Big|Huge|Massive|Substantial|Significant} BiologicalSystems

Hydrodeoxygenation of Guaiacol {Over|More than} Orthorhombic Molybdenum Carbide: A DFT and Microkinetic Study

Electrophilic Sulfur Reagent {Design|Style|Design and style} Enables Catalytic syn-Carbosulfenylation of Unactivated Alkenes

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Phase-field investigation of lithium electrodeposition under different applied overpotentials and operating temperatures

Terahertz Spectroscopy: An investigation {of the|from the|in the|on the|with the|of your} Structural Dynamics of Freeze-Dried PLGA Microspheres

Assembling Nanoparticle Clusters by Kinetic Control Using Weakly Interacting DNA

Combinatorial library screening of quinadoline B derivatives against SARS-CoV-2 RNA-dependent RNA polymerase