Results 51 to 60 of about 1,494 (137)

Dinâmica molecular: teoria e aplicações em planejamento de fármacos

Eclética Química, 2018
Molecular dynamics (MD) is a powerful computational tool used for rational drug design in medicinal chemistry. MD is an extension of Molecular Mechanics, where the dynamic behavior of a molecular system is simulated through numerical integration of the ...
Adriana Mieco Namba, Vinícius Barreto da Silva, Carlos Henrique Tomich de Paula da Silva   +2 more
doaj   +1 more source

Microencapsulation of bioactive compounds from peanut residues: stability study and application in yogurt

Journal of the Science of Food and Agriculture, Volume 106, Issue 11, Page 6472-6484, 30 August 2026.
Abstract BACKGROUND Peanut skin, a byproduct of peanut processing, is a rich source of phenolic compounds (520.65 mgGAE (100 g)−1 d.b.) with strong antioxidant capacity, but which remains underutilized. The direct incorporation of phenolic extracts into dairy products is challenging, due to their instability during processing and storage and possible ...
Ana Carolina Tucumantel Ribeiro, Victor Waldemar Pinto, Jaqueline LS Cavalcante, Nathalia Almeida Costa, Bárbara M Lepaus, Juliana A Macedo, Patrícia Blumer ZR Sá, Sílvia Cristina Sobottka Rolim de Moura   +7 more
wiley   +1 more source

La dinámica molecular es una película a escala nanoscópica

Educación Química
Las simulaciones de dinámica molecular se han vuelto cada vez más accesibles a la comunidad científica, permitiendo el estudio detallado de sistemas a escala nanoscópica con una resolución comparable a una "película" en tiempo real.
Adrián Durán Vargas, Juan Felipe Avellaneda Tamayo, José Luis Medina Franco, Enrique García Hernández   +3 more
doaj   +3 more sources

Comportamiento del SDS localizado en la región interfacial del sistema agua/n-octano. Un estudio usando dinámica molecular

ACI Avances en Ciencias e Ingenierías, 2016
En este trabajo, usando dinámica molecular se determinaron las propiedades interfaciales y el comportamiento del Dodecil Sulfato de Sodio (SDS) ubicado en la región interfacial de los sistemas vacío/agua y agua/n-octano.
José Gregorio Parra, Yosslen R. Aray
doaj   +1 more source

Biobased Polyurethane Films Based on Andiroba (Carapa guianensis) and Buriti (Mauritia flexuosa) Oil Polyols

Journal of Applied Polymer Science, Volume 143, Issue 30, August 10, 2026.
Polyurethane films were prepared from andiroba (Carapa guianensis) and buriti (Mauritia flexuosa) oil‐derived polyols, emphasizing their potential as bio‐based materials. UV–Vis analysis indicates the retention of carotenoid‐related chromophoric features within the polymer matrix.
João A. P. da Silva, Amanda L. Ferreira, Felipe F. C. Tavares, Chana M. da Silva, Cesar L. Petzhold, Nilo S. M. Cardozo   +5 more
wiley   +1 more source

Development and Characterization of ZnO‐Filled and Maleic Anhydride‐Compatibilized PP/SEBS Blends for 3D‐Printing Filaments

Journal of Applied Polymer Science, Volume 143, Issue 29, August 5, 2026.
PP/SEBS/MA/ZnO filaments produced by bench‐top single‐screw extrusion show refined morphology, increased crystallinity, improved thermal robustness, and preliminary FFF printability, demonstrating a practical route for functional filament development. ABSTRACT Currently, single‐screw extrusion offers a versatile and accessible route to produce polymer ...
Chiara das Dores do Nascimento, Cesar Aguzzoli, Everton Granemann Souza, Ana Cristina Beitia Kraemer Moraes, Fabricio Celso, Patricia Oliveira Schmitt, Lincoln Audrew Cordeiro, Fernanda Langone, Marlon Bender Bueno Rodrigues, Luana Vaz Tholozan, Neftali Lenin Villarreal Carreno, André Luiz Missio, Amanda Dantas de Oliveira   +12 more
wiley   +1 more source

Evidence of a Potential Nursery Area for the Great Hammerhead Shark, Sphyrna mokarran, in the Largest Coral Reef System of the Southwestern Atlantic

Ecology and Evolution, Volume 16, Issue 8, August 2026.
We present evidence suggesting that the Abrolhos Bank functions as key habitat for early life stages of Sphyrna mokarran. Kernel density estimation revealed spatially structured aggregations, with neonates and young‐of‐the‐year concentrated in shallow reef‐associated areas. Temporal variation in catch per unit effort (CPUE) indicated recruitment pulses
Jones Santander‐Neto, Rodrigo Barreto, Guilherme dos Santos Lírio, Michael Heithaus, Otto Bismarck Fazzano Gadig, Maurício Hostim‐Silva   +5 more
wiley   +1 more source

ORF8 and Health Complications of COVID-19 in Down Syndrome Patients

Frontiers in Genetics, 2022
Antonio Bensussen, Antonio Valcarcel, Elena R. Álvarez-Buylla, Elena R. Álvarez-Buylla, José Díaz   +4 more
doaj   +1 more source

SIMULACIÓN POR DINÁMICA MOLECULAR DEL KNbO3: DINÁMICA RELAJACIONAL VS. DISPLACIVA

Anales (Asociación Física Argentina), 2013
La dinámica de la transición ferroeléctrica en KNbO3 es estudiada mediante una simulación por dinámica molecular en el marco del modelo de polarizabilidad no lineal del oxígeno.
M. Sepliarsky, R. L. Migoni, M. G. Stachiotti   +2 more
doaj  

Green Synthesis of Silver Nanoparticles Using Root Extract of Gomphrena vaga Mart.: Metabolomic Insights Into Nanoparticle Formation and Antimicrobial Activity

Nano Select, Volume 7, Issue 8, August 2026.
This study presents the green synthesis of ultrasmall silver nanoparticles using Gomphrena vaga Mart. root extract. The nanoparticles synthesized were stable and showed good broad‐spectrum antibacterial activity against Gram‐positive and Gram‐negative bacteria in initial studies.
Uedson da Silva das Neves, Thyerre Santana da Costa, Symone Costa de Castro, Maelson Cardoso Lacerda, Mauro Alves Bueno, Ljubica Tasic   +5 more
wiley   +1 more source