Results 131 to 140 of about 10,116 (242)
<i>In Silico</i> Perspective on Avobenzone, Octisalate, Octocrylene, Homosalate, and Bemotrizinol as Organic UV Filters Using DFT, TD-DFT, and Molecular Dynamics. [PDF]
Rigoni ME, de Lazaro SR, de Lara LS.
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ABSTRACT 2‐Phenylethylamine (2‐PEA), an aromatic biogenic amine, demonstrates significant physiological and toxicological effects on human health. A variety of conventional methods have been widely used for the determination of 2‐PEA. However, the necessity of complex sample preparation and high cost of instrumentation may pose challenges to their ...
Fatemeh Nami +3 more
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Computational insights into solvent encapsulation and host-guest recognition by calix[4]arene. [PDF]
Khalil K, Fiser B, Małecka M.
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ABSTRACT Tetracycline (TC) is a commonly prescribed broad‐spectrum antibiotic, and its widespread use together with its persistence in biological matrices, particularly urine, has raised serious concerns related to clinical safety, public health and the emergence of antimicrobial resistance, underscoring the need for its accurate and sensitive ...
Sanaz Naghinejad Orang +2 more
wiley +1 more source
Identifying routes for transferring spin polarization from parahydrogen to protic solvents.
Vaneeckhaute E +4 more
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Elucidating the Solvent-Dependent Solvation and Structural Stability of Irinotecan: A Molecular Simulation Study. [PDF]
Bitabo MM +4 more
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This work demonstrates the successful implementation of protic ionic liquids in MXene‐based supercapacitor. This study introduces trimethylammonium trifluoromethanesulfonate (N111HTFO) as a promising salt for formulating aqueous protic ionic liquid (PIL) electrolytes in electrochemical supercapacitors. The temperature dynamic transport behavior of this
Indrajit Mahadev Patil +7 more
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Potassium-Doped Borophane Nanosheets: A Multifunctional Platform for Reversible Hydrogen Storage and Metal-Free Hydrogen Transfer. [PDF]
Anju RS +12 more
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The CoE‐AmDH panel enables sustainable access to chiral amines using diverse amine (AmDH) and amino acid dehydrogenases (AADH). Utilizing formate (FDH) or glucose dehydrogenase (GDH) for cofactor regeneration, this study establishes a robust screening platform for mild reductive aminations.
R. Tilly Bradshaw Allen +2 more
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Protic Ionic Liquid-H<sub>2</sub>O Mixtures─Structure, Interactions, and Structure-Property Relationships. [PDF]
Kaljusmaa LM +6 more
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