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Journal of Computational Chemistry
|
January 11, 2024
Evaluating quantum entanglement generation in two-dimensional graphene systems through lithium ion interactions: A DFT-based study
Lucas de S Silva, Guilherme Colherinhas, Wesley B Cardoso
ACS Physical Chemistry Au
|
February 2, 2026
Atomic-Scale Insights into Phosphorene-Ionic Liquid Interface with Ab Initio Molecular Dynamics
Debora Ariana C da Silva, Guilherme Colherinhas, Eudes Eterno Fileti
ACS Physical Chemistry Au
|
January 27, 2025
Quantum Molecular Dynamics Approach to Understanding Interactions in Betaine Chloride and Amino Acid Natural Deep Eutectic Solvents
Eudes Eterno Fileti, Henrique de Araujo Chagas, Guilherme Colherinhas, et al.
Journal of Computational Chemistry
|
December 7, 2020
Molecular dynamic simulations, GIAO-NMR and TD-DFT spectroscopy analyze for zwitterionic isoleucine (ILE)<sub>N</sub> , 1 ≤ N ≤ 6, in water solution
Karinna Mendanha, Richard Costa Prado, Leonardo Bruno Assis Oliveira, et al.
The Journal of Physical Chemistry. A
|
February 14, 2019
Robust Entanglement Generation in Lithium Ions Mediated by Graphene Quantum Dots Interaction
Wesley B Cardoso, Ardiley T Avelar, Norton G de Almeida, et al.
ACS Physical Chemistry Au
|
December 4, 2025
Molecular Dynamics Study of Functionalized Gold Nanoparticles: Structural and Aggregation Behavior under Varying Ionic Strength
Esequias Coelho, Douglas Xavier de Andrade, Agnaldo Rosa de Almeida, et al.
Computational Biology and Chemistry
|
March 4, 2026
Hydrogen bonding and membrane anchoring of the antimicrobial peptide NP-3a investigated through molecular dynamics
Ana Clara D Aquino, Karinna Mendanha, Herbert de C Georg, et al.
ACS Omega
|
June 15, 2026
Does Electrode Spacing Truly Control Capacitance and Energy Density in Graphene-Based Supercapacitors? A Molecular Simulation Perspective
Davi de Oliveira Guedes, Henrique de Araujo Chagas, Iuliia V Voroshylova, et al.
ACS Applied Materials & Interfaces
|
February 16, 2026
Cholesterol-Driven Optimization of Liposomal Systems for Ivermectin Capture: Insights from Experimental and Molecular Dynamics Studies
Alexandre C M Barros, Jader Pires, Karinna Mendanha, et al.
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Showing results (21-30 of 29) with videos related to
Sort By:
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You have reached the last page of results.
This site can display upto 29 results.
Journal of Computational Chemistry
|
January 11, 2024
Evaluating quantum entanglement generation in two-dimensional graphene systems through lithium ion interactions: A DFT-based study
Lucas de S Silva, Guilherme Colherinhas, Wesley B Cardoso
ACS Physical Chemistry Au
|
February 2, 2026
Atomic-Scale Insights into Phosphorene-Ionic Liquid Interface with Ab Initio Molecular Dynamics
Debora Ariana C da Silva, Guilherme Colherinhas, Eudes Eterno Fileti
ACS Physical Chemistry Au
|
January 27, 2025
Quantum Molecular Dynamics Approach to Understanding Interactions in Betaine Chloride and Amino Acid Natural Deep Eutectic Solvents
Eudes Eterno Fileti, Henrique de Araujo Chagas, Guilherme Colherinhas, et al.
Journal of Computational Chemistry
|
December 7, 2020
Molecular dynamic simulations, GIAO-NMR and TD-DFT spectroscopy analyze for zwitterionic isoleucine (ILE)<sub>N</sub> , 1 ≤ N ≤ 6, in water solution
Karinna Mendanha, Richard Costa Prado, Leonardo Bruno Assis Oliveira, et al.
The Journal of Physical Chemistry. A
|
February 14, 2019
Robust Entanglement Generation in Lithium Ions Mediated by Graphene Quantum Dots Interaction
Wesley B Cardoso, Ardiley T Avelar, Norton G de Almeida, et al.
ACS Physical Chemistry Au
|
December 4, 2025
Molecular Dynamics Study of Functionalized Gold Nanoparticles: Structural and Aggregation Behavior under Varying Ionic Strength
Esequias Coelho, Douglas Xavier de Andrade, Agnaldo Rosa de Almeida, et al.
Computational Biology and Chemistry
|
March 4, 2026
Hydrogen bonding and membrane anchoring of the antimicrobial peptide NP-3a investigated through molecular dynamics
Ana Clara D Aquino, Karinna Mendanha, Herbert de C Georg, et al.
ACS Omega
|
June 15, 2026
Does Electrode Spacing Truly Control Capacitance and Energy Density in Graphene-Based Supercapacitors? A Molecular Simulation Perspective
Davi de Oliveira Guedes, Henrique de Araujo Chagas, Iuliia V Voroshylova, et al.
ACS Applied Materials & Interfaces
|
February 16, 2026
Cholesterol-Driven Optimization of Liposomal Systems for Ivermectin Capture: Insights from Experimental and Molecular Dynamics Studies
Alexandre C M Barros, Jader Pires, Karinna Mendanha, et al.
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of 3