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329 Results Found

  • Article
  • Open Access
3 Citations
3,164 Views
12 Pages

Determination of Pair Interaction Parameters of Multicomponent Polymer Systems

  • Anatoly E. Chalykh,
  • Vladimir K. Gerasimov,
  • Tatiana F. Petrova and
  • Anna A. Shcherbina

25 December 2023

From the examples of three and four-component polymer–polymer systems characterized by amorphous separation, an original technique for determining the pair parameters of interaction between components based on the sorption isotherms of common s...

  • Article
  • Open Access
1 Citations
695 Views
22 Pages

10 April 2026

Volatile amphiphiles and surfactant mixtures have gained wide applications in diverse areas of industry, cosmetics, and medicine. The surface tension isotherms, measured at different solute ratios, and data processing, using appropriate theoretical m...

(This article belongs to the Section Physical Chemistry)
  • Article
  • Open Access
2 Citations
1,868 Views
14 Pages

13 December 2023

The subject of polymer–polymer pair interaction is highly important, bearing in mind that such pairs are used in the construction of machines and equipment, among other uses. Considering that the characteristics of polymer–polymer sliding...

(This article belongs to the Section Polymer Processing and Engineering)
  • Article
  • Open Access
7 Citations
5,203 Views
15 Pages

Stability and Dynamics of Dark-Bright Soliton Bound States Away from the Integrable Limit

  • Garyfallia C. Katsimiga,
  • Jan Stockhofe,
  • Panagiotis G. Kevrekidis and
  • Peter Schmelcher

13 April 2017

The existence, stability, and dynamics of bound pairs of symbiotic matter waves in the form of dark-bright soliton pairs in two-component mixtures of atomic Bose–Einstein condensates is investigated. Motivated by the tunability of the atomic interact...

(This article belongs to the Special Issue Guided-Wave Optics)
  • Article
  • Open Access
407 Views
24 Pages

This study examines interactions in aqueous electrolyte solutions using the equations of the Scatchard and Friedman models. The six mixing parameters of the Scatchard model, bAB(01); bAB(02); bAB(03); bAB(12); bAB(13) and bAB(23), were obtained from...

(This article belongs to the Special Issue Electrolyte Solutions: Experiments, Properties and Applications)
  • Article
  • Open Access
1 Citations
2,648 Views
10 Pages

17 October 2024

DNA-RNA hybrid duplexes play essential roles during the reverse transcription of RNA viruses and DNA replication. The opening and conformation changes of individual base pairs are critical to their biological functions. However, the microscopic mecha...

(This article belongs to the Special Issue Advances in Computational and Theoretical Chemistry—2nd Edition)
  • Article
  • Open Access
2,362 Views
13 Pages

7 January 2025

This work deals with the key constituent behind the existence of superfluid states in ultracold fermionic gases confined in a harmonic trap in 2D, namely, the formation of Cooper pairs in the presence of a Fermi sea in inhomogeneous confinement. For...

(This article belongs to the Special Issue Quantum Technologies with Cold Atoms)
  • Article
  • Open Access
1 Citations
3,150 Views
15 Pages

The Optimization of Numerical Algorithm Parameters with a Genetic Algorithm to Animate Letters of the Sign Alphabet

  • Sergio Hernandez-Mendez,
  • Carlos Hernández-Mejía,
  • Delia Torres-Muñoz and
  • Carolina Maldonado-Mendez

At present, the development of animation-based works for human–computer interaction applications has increased. To generate animations, actions are pre-recorded and animation flows are configured. In this research, from two images of letters of...

  • Article
  • Open Access
4,118 Views
11 Pages

A Preview of a Construction of a Crystal Lattice Based on Intermolecular Interactions

  • Vladimír Hejtmánek,
  • Martin Dračínský and
  • Jan Sýkora

19 March 2019

A general procedure of crystal packing reconstruction using a certain number of intermolecular interactions is introduced and demonstrated on the crystal structure of l-histidine·HCl·H2O. Geometric restrictions based on intermolecular i...

(This article belongs to the Special Issue NMR Crystallography)
  • Proceeding Paper
  • Open Access
569 Views
6 Pages

4 February 2026

We present a computational model for studying morphogenesis based on pairwise interactions among cells in this article. Extending a previous single-particle model, we represent each cell using two particles connected by an internal link. This two-par...

(This article belongs to the Proceedings of 8th International Conference on Knowledge Innovation and Invention)
  • Article
  • Open Access
7 Citations
2,516 Views
14 Pages

While undergoing structural deformation, DNA experiences changes in the interactions between its internal base pairs, presenting challenges to conventional elastic methods. To address this, we propose the Discrete Critical State (DCS) model in this p...

(This article belongs to the Special Issue Molecular Insights into Macromolecules Structure, Function, and Regulation)
  • Article
  • Open Access
44 Citations
11,754 Views
25 Pages

Direct Determination of Chitosan–Mucin Interactions Using a Single-Molecule Strategy: Comparison to Alginate–Mucin Interactions

  • Kristin E. Haugstad,
  • Armend G. Håti,
  • Catherine T. Nordgård,
  • Patricia S. Adl,
  • Gjertrud Maurstad,
  • Marit Sletmoen,
  • Kurt I. Draget,
  • Rita S. Dias and
  • Bjørn T. Stokke

29 January 2015

Aqueous chitosan possesses attractive interaction capacities with various molecular groups that can be involved in hydrogen bonds and electrostatic and hydrophobic interactions. In the present paper, we report on the direct determination of chitosan–...

(This article belongs to the Collection Polysaccharides)
  • Article
  • Open Access
2 Citations
1,581 Views
25 Pages

A Deterministic Combinatorial Approach to Investigate Interactions of Soil Hydraulic Parameters on River Flow Modelling

  • Dhiego da Silva Sales,
  • David de Andrade Costa,
  • Jader Lugon Junior,
  • Ramiro Joaquim Neves and
  • Antônio José da Silva Neto

5 September 2025

Hydrological modeling is essential for the sustainable management of watershed systems. Physically based models like MOHID-Land simulate soil water dynamics using Richards’ equation, parameterized through the van Genuchten–Mualem (VGM) mo...

(This article belongs to the Section Soil and Water)
  • Article
  • Open Access
10 Citations
2,677 Views
9 Pages

Alignments of a Microparticle Pair in a Glow Discharge

  • Evgeny A. Lisin,
  • Evgeny A. Kononov,
  • Eduard A. Sametov,
  • Mikhail M. Vasiliev and
  • Oleg F. Petrov

13 December 2021

Stability of a vertically aligned microparticle pair in a stratified glow DC discharge is experimentally investigated. Using laser perturbations, it is shown that, for the same discharge parameters, a pair of microparticles can be suspended in two st...

(This article belongs to the Section Physical Chemistry)
  • Article
  • Open Access
8 Citations
3,149 Views
20 Pages

Flory’s random coil model assumes that conformational fluctuations of amino acid residues in unfolded poly(oligo)peptides and proteins are uncorrelated (isolated pair hypothesis, IPH). This implies that conformational energies, entropies and so...

(This article belongs to the Collection Feature Papers in Molecular Structure and Dynamics)
  • Article
  • Open Access
4 Citations
3,796 Views
8 Pages

We analyze the many-body phases of an ensemble of particles interacting via a Lifshitz–Petrich–Gaussian pair potential in a harmonic confinement. We focus on specific parameter regimes where we expect decagonal quasiperiodic cluster arran...

(This article belongs to the Special Issue SuperFluctuations, 3rd Edition)
  • Article
  • Open Access
660 Views
16 Pages

Generation and Transfer of Entanglement in a Circular Spin System

  • Vinh Le Duc,
  • Joanna K. Kalaga and
  • Wiesław Leoński

1 April 2026

We consider an Ising-type model of six interacting spins in a closed circular configuration. We discuss two scenarios in which the system is initially in either an entangled or a product state. In the first scenario, we analyze how entanglement is tr...

(This article belongs to the Special Issue Entropy in Classical and Quantum Information Theory with Applications)
  • Article
  • Open Access
6 Citations
4,182 Views
16 Pages

Protein–Protein Interactions Efficiently Modeled by Residue Cluster Classes

  • Albros Hermes Poot Velez,
  • Fernando Fontove and
  • Gabriel Del Rio

Predicting protein–protein interactions (PPI) represents an important challenge in structural bioinformatics. Current computational methods display different degrees of accuracy when predicting these interactions. Different factors were propose...

(This article belongs to the Special Issue Take and Give: Protein Structure Analysis and Prediction with Statistical Scoring Functions)
  • Article
  • Open Access
10 Citations
3,267 Views
16 Pages

11 June 2022

It is important for elucidating the regulation mechanism of life activities, as well as for the prevention, diagnosis, and drug design of diseases, to study protein–protein interactions (PPIs). Here, we investigated the interactions of human se...

(This article belongs to the Section Biomacromolecules: Proteins, Nucleic Acids and Carbohydrates)
  • Article
  • Open Access
1 Citations
2,690 Views
13 Pages

4 August 2021

In this work, simulations of friction at the atomic level were performed to evaluate the influence of inclusions coming from metallic nanoadditives in the friction pair. The simple 2D model was applied considering appropriate values of Lennard–Jones...

(This article belongs to the Section Smart and Functional Materials)
  • Article
  • Open Access
7 Citations
3,475 Views
12 Pages

26 August 2020

The hypothesis of Lorentz violation in the neutrino sector has intrigued scientists for the last two to three decades. A number of theoretical arguments support the emergence of such violations, first and foremost for neutrinos, which constitute the...

(This article belongs to the Special Issue Beyond the Standard Models in Particle Physics and Cosmology)
  • Article
  • Open Access
4 Citations
5,357 Views
14 Pages

Molecular Dynamics Simulation of Homo-DNA: The Role of Crystal Packing in Duplex Conformation

  • Jonathan H. Sheehan,
  • Jarrod A. Smith,
  • Pradeep S. Pallan,
  • Terry P. Lybrand and
  • Martin Egli

16 October 2019

The (4′→6′)-linked DNA homolog 2′,3′-dideoxy-β-D-glucopyranosyl nucleic acid (dideoxy-glucose nucleic acid or homo-DNA) exhibits stable self-pairing of the Watson–Crick and reverse-Hoogsteen types, but does not...

(This article belongs to the Special Issue Nucleic Acid Crystallography)
  • Communication
  • Open Access
12 Citations
1,888 Views
10 Pages

Measuring quantum-statistical, femtoscopic (including final state interactions) momentum correlations with final state interactions in high-energy nucleus-nucleus collisions reveal the space-time structure of the particle-emitting source created. In...

(This article belongs to the Special Issue Zimányi School – Heavy Ion Physics)
  • Article
  • Open Access
9 Citations
6,333 Views
14 Pages

2 December 2011

Molecular docking is an important method for the research of protein-protein interaction and recognition. A protein can be considered as a network when the residues are treated as its nodes. With the contact energy between residues as link weight, a...

(This article belongs to the Section Physical Chemistry, Theoretical and Computational Chemistry)
  • Article
  • Open Access
12 Citations
6,070 Views
16 Pages

28 September 2015

Förster Resonance Energy Transfer (FRET) enables the observation of interactions at the nanoscale level through the use of fluorescence optical imaging techniques. In FRET, fluorescence lifetime imaging can be used to quantify the fluorescence lifeti...

  • Article
  • Open Access
21 Citations
3,915 Views
12 Pages

13 December 2019

Load-sharing behavior is very important for power-split gearing systems. Taking the multistage planetary gear train transmission of an Million Watt (MW) wind generator as the investigation object, and based on the gear transmission system of a wind g...

(This article belongs to the Special Issue Wind Power Technologies)
  • Article
  • Open Access
8 Citations
5,142 Views
18 Pages

19 June 2020

To improve the low viscosity and poor lubrication characteristics of high-water-based hydraulic liquid, the abrasion and leakage problems in hydraulic components need to be addressed. In a high water-based hydraulic motor with self-balanced distribut...

(This article belongs to the Special Issue Intelligent Fluid Power Drive Technology)
  • Article
  • Open Access
1 Citations
4,534 Views
14 Pages

16 June 2018

Structural and vibrational studies have been carried out for the most stable conformer of 3,3′-ethane-1,2-diyl-bis-1,3,5-triazabicyclo[3.2.1]octane (ETABOC) at the DFT/B3LYP/6-31G(dp) level using the Gaussian 03 software. In light of the comput...

  • Article
  • Open Access
3 Citations
4,009 Views
12 Pages

Critical Current Density in d-Wave Hubbard Superconductors

  • José Samuel Millán,
  • Jorge Millán,
  • Luis A. Pérez and
  • Harold S. Ruiz

15 December 2022

In this work, the Generalized Hubbard Model on a square lattice is applied to evaluate the electrical current density of high critical temperature d-wave superconductors with a set of Hamiltonian parameters allowing them to reach critical temperature...

(This article belongs to the Special Issue Advances in Superconducting Materials: Characterization, Properties and Applications)
  • Feature Paper
  • Article
  • Open Access
2 Citations
4,104 Views
16 Pages

20 February 2023

The 1-dithiocarboxy-2-ethoxy-1-(isoquinolin-2-yl)-2-oxoethan-1-ylid (iQTCY) zwitterionic molecule has been studied by computational and spectral means in order to establish some of its structural parameters in the ground electronic state as well as t...

(This article belongs to the Collection Feature Papers in Chemistry)
  • Article
  • Open Access
894 Views
21 Pages

Human Action Generation from Skeleton Sequences: A Comparative Study of Mathematical and Bio-Inspired Algorithms

  • Sergio Hernandez-Mendez,
  • Carolina Maldonado-Mendez,
  • Sergio Fabian Ruiz-Paz,
  • Hiram García-Lozano,
  • Antonio Marin-Hernandez and
  • Oscar Alonso-Ramirez

In recent years, animation-based systems for human-computer interaction have attracted increasing attention. This work proposes a hybrid framework that combines mathematical modeling and bio-inspired optimization algorithms to generate motion sequenc...

  • Article
  • Open Access
507 Views
33 Pages

4 September 2026

Background. Human populations are exposed to complex chemical mixtures, making interaction detection a central challenge in environmental epidemiology. We benchmarked methods for prediction and recovery of interaction structure. Methods. Eight approa...

  • Article
  • Open Access
22 Citations
3,840 Views
21 Pages

11 September 2021

This paper reports research on the frictional behavior of a textured surface against several materials under dry and lubricated conditions, and this is aimed to provide design guidelines on the surface texturing for wide-ranging industrial applicatio...

(This article belongs to the Special Issue Friction and Wear of Materials Surfaces)
  • Article
  • Open Access
18 Citations
8,690 Views
23 Pages

1 August 2017

We present a systematic coarse-graining (CG) strategy for many particle molecular systems based on cluster expansion techniques. We construct a hierarchy of coarse-grained Hamiltonians with interaction potentials consisting of two, three and higher b...

(This article belongs to the Special Issue Thermodynamics and Statistical Mechanics of Small Systems)
  • Article
  • Open Access
1 Citations
712 Views
17 Pages

Based on the fractional entropy originating from fractional quantum mechanics, the fractional holographic dark energy (FHDE) model has been proposed. In this paper, we consider an interaction between the pressureless matter and FHDE and analyze three...

(This article belongs to the Topic Dark Matter, Dark Energy and Cosmological Anisotropy)
  • Article
  • Open Access
6 Citations
3,268 Views
14 Pages

29 January 2024

This study presents an approach using multiple linear regression to quantify the impact of meteorological parameters and chemical species on aerosol pH variance in an urban setting in the Pearl River Delta, China. Additionally, it assesses the contri...

(This article belongs to the Topic Accessing and Analyzing Air Quality and Atmospheric Environment)
  • Article
  • Open Access
30 Citations
7,811 Views
12 Pages

23 October 2015

Accessing information efficiently is vital for animals to make the optimal decisions, and it is particularly important when they are facing predators. Yet until now, very few quantitative conclusions have been drawn about the information dynamics in...

(This article belongs to the Section Complexity)
  • Article
  • Open Access
3 Citations
3,936 Views
23 Pages

5 December 2023

Organic acids (3-chlorobenzoic acid and 4-chlorobenzoic acid) were treated with 4-amino-2-chloropyridine and 2-amino-4-chloropyridine as coformers for cocrystallization. Acid/base pairs afforded a cocrystal (3-chlorobenzoic acid and 4-amino-2-chlorop...

  • Article
  • Open Access
5 Citations
2,312 Views
22 Pages

Some Aryl-1,2,4-triazol-1-ium Phenacylids in Binary Hydroxyl Solvent Mixtures. Computational and Spectral Study

  • Dana Ortansa Dorohoi,
  • Dan Gheorghe Dimitriu,
  • Ana Cezarina Morosanu,
  • Nicoleta Puica Melniciuc,
  • Ion Hurjui,
  • Mihaela Miron,
  • Gabriel Grigore Mariciuc,
  • Valentina Closca and
  • Corina Cheptea

8 September 2021

Four carbanion monosubstituted p-aryl-1,2,4-triazol-1-ium methylids are subjected to a comparative study between their spectral and quantum-mechanical parameters in order to obtain more information about their structural features in hydroxyl solvents...

(This article belongs to the Special Issue Quantum Chemistry)
  • Article
  • Open Access

19 October 2026

Adjacent deep excavations may interact through stress redistribution, deformation propagation, structural interaction, and groundwater variation. Existing risk assessment methods mainly focus on individual indicators or single excavations, which may...

  • Article
  • Open Access
5 Citations
1,827 Views
17 Pages

29 August 2024

Monte Carlo simulations were conducted to investigate the interaction between nucleation and the rates of chemical reduction in Au/Ag, Au/Pt and Au/Pd nanoparticles prepared in microemulsions using a one-pot method. The impact of nucleation on final...

(This article belongs to the Section Computation and Simulation on Metals)
  • Article
  • Open Access
2 Citations
3,428 Views
12 Pages

Dephasing Process of a Single Atom Interacting with a Two-Mode Field

  • Eied M. Khalil,
  • Kamal Berrada,
  • Sayed Abdel-Khalek,
  • Beida Alsubei and
  • Hichem Eleuch

22 February 2021

We consider the interaction of a qubit system with a two-mode field in the presence of multi-photon transition and phase damping effect. We use the master equation to obtain the density operator when the qubit is initially prepared in its excited sta...

(This article belongs to the Special Issue Quantum Mechanics and Its Foundations)
  • Article
  • Open Access
35 Citations
7,549 Views
26 Pages

Securing Additive Manufacturing with Blockchains and Distributed Physically Unclonable Functions

  • Bertrand Cambou,
  • Michael Gowanlock,
  • Julie Heynssens,
  • Saloni Jain,
  • Christopher Philabaum,
  • Duane Booher,
  • Ian Burke,
  • Jack Garrard,
  • Donald Telesca and
  • Laurent Njilla

Blockchain technology is a game-changing, enhancing security for the supply chain of smart additive manufacturing. Blockchain enables the tracking and recording of the history of each transaction in a ledger stored in the cloud that cannot be altered...

(This article belongs to the Special Issue Feature Papers in Hardware Security)
  • Article
  • Open Access
1 Citations
1,682 Views
16 Pages

29 November 2025

This paper presents a method for uncovering hidden analytic relationships among the fundamental parameters of the Standard Model (SM), a foundational theory in physics that describes the fundamental particles and their interactions, using symbolic re...

(This article belongs to the Section Computational and Mathematical Physics, AI and Machine Learning)
  • Article
  • Open Access
2 Citations
3,692 Views
22 Pages

Investigating the Intervention Parameters of Endogenous Paired Associative Stimulation (ePAS)

  • Gemma Alder,
  • Nada Signal,
  • Alain C. Vandal,
  • Sharon Olsen,
  • Mads Jochumsen,
  • Imran Khan Niazi and
  • Denise Taylor

12 February 2021

Advances in our understanding of neural plasticity have prompted the emergence of neuromodulatory interventions, which modulate corticomotor excitability (CME) and hold potential for accelerating stroke recovery. Endogenous paired associative stimula...

(This article belongs to the Special Issue Collection on Clinical Neuroscience)
  • Article
  • Open Access
7 Citations
5,697 Views
15 Pages

Association between Rumination Times Detected by an Ear Tag-Based Accelerometer System and Rumen Physiology in Dairy Cows

  • Anne Simoni,
  • Andrew Hancock,
  • Christian Wunderlich,
  • Marcus Klawitter,
  • Thomas Breuer,
  • Felix König,
  • Karina Weimar,
  • Marc Drillich and
  • Michael Iwersen

20 February 2023

Monitoring rumination activity is considered a useful indicator for the early detection of diseases and metabolic disorders. Accelerometer-based sensor systems provide health alerts based on individual thresholds of rumination times in dairy cows. De...

(This article belongs to the Special Issue Artificial Intelligence (AI) Applied to Animal Health and Welfare)
  • Article
  • Open Access
9 Citations
4,310 Views
15 Pages

Periodic and Solitary Wave Solutions of the Long Wave–Short Wave Yajima–Oikawa–Newell Model

  • Marcos Caso-Huerta,
  • Antonio Degasperis,
  • Priscila Leal da Silva,
  • Sara Lombardo and
  • Matteo Sommacal

4 July 2022

Models describing long wave–short wave resonant interactions have many physical applications, from fluid dynamics to plasma physics. We consider here the Yajima–Oikawa–Newell (YON) model, which was recently introduced, combining the...

(This article belongs to the Special Issue Nonlinear Wave Hydrodynamics, Volume II)
  • Article
  • Open Access
4,394 Views
16 Pages

A kind of surface plasmon waveguide composed of two nested cylindrical dielectric parallel nanowire pairs coated with graphene was designed and studied. The dependence of the mode characteristics and the normalized gradient force of the lowest two mo...

(This article belongs to the Section Optoelectronics and Optical Materials)
  • Communication
  • Open Access
2,179 Views
7 Pages

A Novel Model Parameter for the Assessment of the Dimerization of n-Butenes over Ni-Containing Aluminosilicate Catalysts

  • Felix Alscher,
  • Ekaterina Borovinskaya,
  • Stephan Peitz and
  • Wladimir Reschetilowski

7 July 2022

Previous investigations on the dimerization of n-butenes over Ni-containing Al-MCM-41/ZSM-5 mixed-phase catalysts have shown a correlation between the conversion and the Ni/(Al + Ni) ratio as well as between the conversion and the metal–support inter...

(This article belongs to the Section Catalytic Materials)
  • Article
  • Open Access
1 Citations
2,967 Views
9 Pages

22 July 2020

We discuss a covariant relativistic Boltzmann equation which describes the evolution of a system of particles in spacetime evolving with a universal invariant parameter τ . The observed time t of Einstein and Maxwell, in the presence of inte...

(This article belongs to the Special Issue Time and Entropy)

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