Results 131 to 140 of about 246,131 (378)
Angewandte Chemie, EarlyView.Integrated structural analysis of N. vulgaris formate dehydrogenase AB, an enzyme with applications in climate change mitigation, is reported. The substrate/product diffusion pathways were fully mapped, and a retention site was identified that transiently holds substrates and has a key role in CO2‐reducing activity.
Guilherme Vilela‐Alves +8 more
wiley +2 more sources
Advanced Science, EarlyView.This study shows that a local, data‐driven AI model can accurately predict diverse optical and chiroptical properties of [6]helicenes using information from close structural neighbours. Combined with genetic algorithms, it enables inverse design for tailored properties, establishing practical structure–property rules for efficient molecular discovery ...
Rafael G. Uceda +8 more
wiley +1 more source
Angewandte Chemie, EarlyView.Spatial orbital‐selective modulation engineering is proposed as a strategy to optimize cocatalyst design, enhance photocatalytic activity, and provide novel insights into the interactions between active sites and adsorbates, as well as catalytic mechanisms.
Duoduo Gao +5 more
wiley +2 more sources
Advanced Energy Materials, EarlyView.This study establishes an in situ electrochemical framework using dense bulk electrodes to identify defect chemistry and surface kinetics. While oxygen vacancy concentration is derived via bias modulation, surface exchange coefficients are quantified at open circuit voltage conditions to isolate kinetics.
Taeyun Kim +5 more
wiley +1 more source
Inorganic nanoparticles: Possible solution for different problems [PDF]
, 2017 Formation and Controlled Growth of Bismuth Titanate Phases into Mesoporous Silica Nanoparticles: An Efficient Self-Sealing Nanosystem for UV Filtering in Cosmetic Formulation.
Benedetti, Alvise
core
Advanced Intelligent Discovery, EarlyView.Bayesian optimization enabled the design of PA56 system with just 8 wt% additives, achieving limiting oxygen index 30.5%, tensile strength 80.9 MPa, and UL‐94 V‐0 rating. Without prior knowledge, the algorithm uncovered synergistic effects between aluminum diethyl‐phosphinate and nanoclay.
Burcu Ozdemir +4 more
wiley +1 more source
Maximal operators associated with Generalized Hermite polynomials and function expansions [PDF]
, 2013 We study the weak and strong type boundedness of maximal heat?diffusion operators associated with the system of generalized Hermite polynomials and with two different systems of generalized Hermite functions. We also give a necessary background to define
Forzani, Liliana Maria +2 more
core +1 more source
Análise química do solo para fins de fertilidade e recomendação de adubação.
A Ciência do Solo contempla um estudo amplo, dentre esses destacam-se a avaliação da fertilidade das terras que dão suporte à classificação, mapeamento e principalmente a práticas de manejo dos solos, tais com calagem e adubação, fundamentais à ...
Tiago Ferreira Simões
semanticscholar +1 more source