ARTICLE
|
doi:10.20944/preprints202402.0100.v1
Subject:
Arts And Humanities,
History
Keywords:
Politics Simulations; world models; Karl W. Deutsch; Science Center Berlin; Club of Rome; Harold Guetzkow
Online: 2 February 2024 (10:16:40 CET)
ARTICLE
|
doi:10.20944/preprints202312.1647.v1
Subject:
Chemistry And Materials Science,
Theoretical Chemistry
Keywords:
transition metal complexes; oxide nanomaterials; NiO; molecular precursors; chemical vapor deposition; density functional theory; simulations
Online: 21 December 2023 (14:40:00 CET)
ARTICLE
|
doi:10.20944/preprints202301.0179.v1
Subject:
Physical Sciences,
Applied Physics
Keywords:
simulation hypothesis; simulating reality; resolution of a simulation; nested simulations; Nyquist-Shannon sampling theorem; probability
Online: 10 January 2023 (07:42:05 CET)
COMMUNICATION
|
doi:10.20944/preprints202109.0225.v1
Subject:
Chemistry And Materials Science,
Nanotechnology
Keywords:
Self-assembly; Metallic nanoparticles; Plasmonic modes; Simulations; Surface charge mappings; Full-width three-quarter maximum
Online: 14 September 2021 (08:45:05 CEST)
ARTICLE
Subject:
Chemistry And Materials Science,
Polymers And Plastics
Keywords:
molecular dynamics simulations; gold; nanoparticles; core-shell; grafted; structural and dynamical properties of polymers; polyethylene
Online: 7 December 2020 (09:27:17 CET)
ARTICLE
|
doi:10.20944/preprints202007.0725.v1
Subject:
Engineering,
Control And Systems Engineering
Keywords:
fluid mechanics; effectiveness of energy conversion; single-action pneumatic actuator; analytical model; simulations; dynamics; asymmetry
Online: 30 July 2020 (12:44:12 CEST)
ARTICLE
|
doi:10.20944/preprints202005.0266.v1
Subject:
Computer Science And Mathematics,
Applied Mathematics
Keywords:
compartmental model; COVID-19; modified Riemann Liouville fractional differential operator; basic reproduction number; numerical simulations
Online: 16 May 2020 (16:16:14 CEST)
ARTICLE
|
doi:10.20944/preprints201805.0100.v1
Subject:
Physical Sciences,
Particle And Field Physics
Keywords:
quantum field theory; local causal models; general relativity theory; spacetime models; discrete spacetime; computer simulations
Online: 7 May 2018 (05:45:19 CEST)
ARTICLE
|
doi:10.20944/preprints201804.0379.v1
Subject:
Physical Sciences,
Particle And Field Physics
Keywords:
quantum field theory; local causal models; general relativity theory; spacetime models; discrete spacetime; computer simulations
Online: 30 April 2018 (11:58:53 CEST)
ARTICLE
|
doi:10.20944/preprints201607.0026.v1
Subject:
Physical Sciences,
Astronomy And Astrophysics
Keywords:
relativistic jets; particle-in-cell simulations; global jets; helical magnetic fields; kinetic instabilities; kink instability
Online: 13 July 2016 (05:37:49 CEST)
ARTICLE
|
doi:10.20944/preprints202110.0178.v1
Subject:
Biology And Life Sciences,
Biochemistry And Molecular Biology
Keywords:
cardiac muscle; cardiac contractility; force generation; enhanced molecular dynamics simulations; allostery; protein folding; disease; hypertrophic cardiomyopathy
Online: 12 October 2021 (12:20:26 CEST)
ARTICLE
Subject:
Physical Sciences,
Particle And Field Physics
Keywords:
econophysics; market dynamics; market networks; price variation; Monte Carlo simulations; mean-field theory; statistical physics models
Online: 19 January 2020 (14:26:32 CET)
ARTICLE
|
doi:10.20944/preprints201811.0250.v1
Subject:
Physical Sciences,
Mathematical Physics
Keywords:
High-Throughput Molecular Dynamics (HTMD) simulations; Nosé-Hoover Chain (NHC); Canonical ensemble; Graphics Processing Units (GPUs).
Online: 9 November 2018 (15:26:49 CET)
ARTICLE
|
doi:10.20944/preprints201809.0205.v1
Subject:
Physical Sciences,
Quantum Science And Technology
Keywords:
Bell-inequalities; quantum nonlocality; computer simulations of Bell tests; local causality; contextuality loophole; photon identification loophole
Online: 12 September 2018 (01:06:46 CEST)
ARTICLE
|
doi:10.20944/preprints202403.1558.v1
Subject:
Engineering,
Electrical And Electronic Engineering
Keywords:
decentralized voltage control; MIMO models; IMC technique; loops interaction; active power support to voltage regulation; robustness; simulations
Online: 26 March 2024 (13:07:24 CET)
ARTICLE
|
doi:10.20944/preprints202403.0185.v1
Subject:
Engineering,
Marine Engineering
Keywords:
Sulina channel; Danube mouths; Black Sea; navigation hazards; historical data; climate scenarios; atmospheric models; wave model simulations
Online: 4 March 2024 (15:53:26 CET)
ARTICLE
|
doi:10.20944/preprints202402.1010.v1
Subject:
Chemistry And Materials Science,
Metals, Alloys And Metallurgy
Keywords:
Multicomponent alloys; High-entropy alloys; Amorphous alloys; Valence electron concentration; Circular metals; Ab initio molecular dynamics simulations
Online: 19 February 2024 (07:48:57 CET)
ARTICLE
|
doi:10.20944/preprints201908.0223.v1
Subject:
Chemistry And Materials Science,
Medicinal Chemistry
Keywords:
LSD1; molecular inhibitors; thieno[3,2-b]pyrrole-5-carboxamide derivatives; Molecular docking; 3D-QSAR; Molecular dynamics simulations
Online: 21 August 2019 (09:54:43 CEST)
ARTICLE
|
doi:10.20944/preprints201704.0108.v1
Subject:
Engineering,
Energy And Fuel Technology
Keywords:
non-equilibrium phase behavior; compositional flow simulations; phase transitions; upscaling; hydrocarbon mixtures; non-equilibrium constant volume depletion
Online: 18 April 2017 (04:05:57 CEST)
ARTICLE
|
doi:10.20944/preprints202401.0543.v1
Subject:
Engineering,
Electrical And Electronic Engineering
Keywords:
Photovoltaic Systems, Battery Storage, Peak Demand Reduction, Statistical Modeling, Time Series Clustering, Operational Optimization, and Monte Carlo Simulations.
Online: 8 January 2024 (10:03:28 CET)
ARTICLE
|
doi:10.20944/preprints202310.2006.v1
Subject:
Physical Sciences,
Applied Physics
Keywords:
inductive power transfer; finite element analysis; Fibre Bragg Gratings; multi-physics simulations; experimental methodology; thermal strain; temperature measurement
Online: 31 October 2023 (07:55:39 CET)
ARTICLE
|
doi:10.20944/preprints202109.0333.v1
Subject:
Biology And Life Sciences,
Biophysics
Keywords:
small RNA Oxys; RNA chaperone Hfq protein; gene expression regulator; molecular dynamics simulations; binding free energy; interaction entropy
Online: 20 September 2021 (12:47:28 CEST)
REVIEW
|
doi:10.20944/preprints202105.0219.v2
Subject:
Biology And Life Sciences,
Biochemistry And Molecular Biology
Keywords:
Logic-based models; Boolean models; executable models; qualitative dynamical modelling; omic data integration; in silico simulations; formal verification
Online: 30 July 2021 (15:05:03 CEST)
ARTICLE
|
doi:10.20944/preprints202105.0011.v1
Subject:
Biology And Life Sciences,
Biochemistry And Molecular Biology
Keywords:
Annocatacin B; ND1 Subunit; Mitochondrial Respiratory Complex I; MRC-I; Molecular Dynamics Simulations; MD; Hirshfeld Charges; MM/PBSA
Online: 3 May 2021 (16:13:49 CEST)
ARTICLE
|
doi:10.20944/preprints202309.1301.v1
Subject:
Physical Sciences,
Fluids And Plasmas Physics
Keywords:
Reynolds-Averaged Navier-Stokes equations; RANS simulations; Turbulence; Hydrodynamic instabilities and mixing; Reactive Tracers; Coupling; Model development and validation
Online: 20 September 2023 (02:47:58 CEST)
ARTICLE
|
doi:10.20944/preprints202107.0655.v1
Subject:
Chemistry And Materials Science,
Biomaterials
Keywords:
cast iron with lamellar graphite; graphite microstructure; mechanical properties; thermal properties; material properties; microstructure simulations; homogenization; material data workflow
Online: 29 July 2021 (12:33:20 CEST)
ARTICLE
|
doi:10.20944/preprints202005.0199.v1
Subject:
Medicine And Pharmacology,
Pharmacology And Toxicology
Keywords:
SARS-CoV-2; COVID-19; CADD; virtual screening; approved drugs; drug repurposing; essential targets; molecular docking; molecular dynamics simulations
Online: 11 May 2020 (13:14:18 CEST)
ARTICLE
|
doi:10.20944/preprints201904.0191.v1
Subject:
Engineering,
Energy And Fuel Technology
Keywords:
ducted photovoltaic; buoyancy cooling; vertical shafts; energy generation; efficiency of photovoltaic; temperature of photovoltaic; CFD simulations of buoyancy; BIPV
Online: 16 April 2019 (13:10:55 CEST)
ARTICLE
|
doi:10.20944/preprints202401.1115.v1
Subject:
Biology And Life Sciences,
Biophysics
Keywords:
Virus modeling; 3D simulations; diffusion-reaction PDEs; realistic reconstructed geometries; unstructured grids; interdisciplinary virus research; coupling manifold and volume effects
Online: 15 January 2024 (08:55:52 CET)
REVIEW
|
doi:10.20944/preprints202308.1518.v1
Subject:
Medicine And Pharmacology,
Medicine And Pharmacology
Keywords:
SARS-CoV-2; main protease; inhibitors; molecular modeling; molecular dynamics simulations; binding energy calculation; ADME properties; potential therapeutics; drug discovery
Online: 22 August 2023 (07:19:37 CEST)
ARTICLE
Subject:
Chemistry And Materials Science,
Food Chemistry
Keywords:
pomegranate tannins; ellagic acid; molecular modelling; α2-adrenoreceptors; α2-ARs; molecular dynamic simulations; antioxidant; natural compounds; antidepressant activity; food chemistry
Online: 1 October 2021 (14:27:20 CEST)
ARTICLE
|
doi:10.20944/preprints202404.0099.v1
Subject:
Public Health And Healthcare,
Physical Therapy, Sports Therapy And Rehabilitation
Keywords:
Ophthalmic trauma; Biomechanical simulations; Optometric interventions; Multivariate Linear Regression; Computational Biomechanics; Hertzian Contact Stress Equation; Sport Injury Mitigation Strategy
Online: 1 April 2024 (14:57:30 CEST)
ARTICLE
|
doi:10.20944/preprints202207.0005.v1
Subject:
Engineering,
Energy And Fuel Technology
Keywords:
Maroon gas; synthetic natural gas; Pink Hydrogen; hydrogen source-water, hydrogen source-hydrocarbon; energy efficient hydro-gen; Thermodynamic simulations; FACTSAGE; DWSIM
Online: 1 July 2022 (07:55:58 CEST)
REVIEW
|
doi:10.20944/preprints201811.0374.v2
Subject:
Physical Sciences,
Astronomy And Astrophysics
Keywords:
particle-in-cell simulations; relativistic jets; the Weibel instability; kink-like instability; mushroom instability; global jets; helical magnetic fields; recollimation shocks
Online: 25 December 2018 (09:01:18 CET)
ARTICLE
|
doi:10.20944/preprints201612.0138.v1
Subject:
Engineering,
Mechanical Engineering
Keywords:
hybrid materials; machine tool structures; modal analysis; machine tool kinematics; aluminium metal foams; aluminium corrugated sandwiches; CFRP materials; FE simulations; damping
Online: 29 December 2016 (07:36:15 CET)
REVIEW
|
doi:10.20944/preprints202312.0580.v2
Subject:
Physical Sciences,
Particle And Field Physics
Keywords:
Quantum Chromo dynamics (QCD); Parton distribution functions (PDFs); DGLAP evolution equation; Quarks and gluons; Monte Carlo simulations; Uncertainties in α s (MZ)
Online: 12 December 2023 (17:27:25 CET)
ARTICLE
|
doi:10.20944/preprints202308.0828.v1
Subject:
Biology And Life Sciences,
Biophysics
Keywords:
global protein dynamics; software integration workflows; cryo-electron microscopy; normal mode analysis; elastic network models; ensemble analysis; principal component analysis; hybrid simulations
Online: 10 August 2023 (10:52:04 CEST)
ARTICLE
|
doi:10.20944/preprints202306.0648.v1
Subject:
Biology And Life Sciences,
Biochemistry And Molecular Biology
Keywords:
SARS-CoV-2 ORF6 – RAE1 binding; 3D molecular structure modelling; molecular dynamics simulations; cell cycle, cyclin E; R-loops; DNA replication stress
Online: 8 June 2023 (13:52:38 CEST)
ARTICLE
|
doi:10.20944/preprints202304.0959.v1
Subject:
Engineering,
Mechanical Engineering
Keywords:
machine learning; mechanical damage detection; pipelines; physics-informed datasets; simulations; welding detection; CNN structure optimization; sensing system; data classification performance and noise robustness
Online: 26 April 2023 (04:59:54 CEST)
ARTICLE
|
doi:10.20944/preprints202207.0058.v1
Subject:
Biology And Life Sciences,
Biophysics
Keywords:
human interferon gamma; human interferon gamma receptor; receptor binding; heparan sulfate; co-receptor; molecular dynamics simulations; sodium chlorate; kynurenine antiproliferative assays; hIFNγ signalling
Online: 5 July 2022 (04:43:05 CEST)
ARTICLE
Subject:
Physical Sciences,
Applied Physics
Keywords:
ECR plasmas; warm electrons; self-consistent simulations; experimental benchmarking; volumetric and space-resolved spectra; X-ray fluorescence; bremsstrahlung; ray-tracing Monte Carlo techniques
Online: 5 October 2021 (08:58:06 CEST)
REVIEW
|
doi:10.20944/preprints202308.0434.v1
Subject:
Medicine And Pharmacology,
Medicine And Pharmacology
Keywords:
In silico studies; drug discovery; SARS-CoV-2; molecular docking; virtual screening; molecular dynamics simulations; drug candidates; antiviral activity; receptor-ligand complex; drug design
Online: 4 August 2023 (11:11:21 CEST)
ARTICLE
|
doi:10.20944/preprints201806.0300.v1
Subject:
Chemistry And Materials Science,
Physical Chemistry
Keywords:
polyelectrolytes; charge regulation; long-range
interactions; Debye-Hückel interactions; transfer matrix; Ising models; semi-grand canonical ensemble; Monte Carlo simulations; conformational
equilibria; variational methods
Online: 19 June 2018 (12:33:38 CEST)
ARTICLE
|
doi:10.20944/preprints202304.0251.v1
Subject:
Physical Sciences,
Atomic And Molecular Physics
Keywords:
radioactive atomic beams; gas stopping cell; supersonic gas jet; in-gas-jet laser resonance ionization spectroscopy; double-nozzle technique; gas dynamic and Monte Carlo simulations
Online: 12 April 2023 (07:30:00 CEST)
REVIEW
|
doi:10.20944/preprints202311.0529.v1
Subject:
Public Health And Healthcare,
Primary Health Care
Keywords:
SARS-CoV-2; Papain-like protease; COVID-19; Molecular modelling; Molecular dynamics simulations; Drug discovery; Antiviral drugs; Inhibitors; Therapeutic agents; therapeutic targets; Irreversible inhibitors; Repurposing drugs
Online: 8 November 2023 (16:11:55 CET)
ARTICLE
|
doi:10.20944/preprints202308.0113.v1
Subject:
Physical Sciences,
Atomic And Molecular Physics
Keywords:
Keywords: gas stopping cell; supersonic gas jet; in-gas-jet laser resonance ionization spectroscopy; double-nozzle technique; RF-only funnel; RF-buncher; gas dynamic and Monte Carlo simulations
Online: 2 August 2023 (02:31:21 CEST)
ARTICLE
|
doi:10.20944/preprints202304.1138.v1
Subject:
Engineering,
Mechanical Engineering
Keywords:
Dynamic Mode Decomposition (DMD); Computational Fluid Dynamics (CFD); Reduced Order Method (ROM); Ahmed Body; Turbulent Flows; High Reynolds Number Flows; Improved Delayed Detached Eddy Simulations (IDDES); Road Vehicle Aerodynamics
Online: 28 April 2023 (07:57:31 CEST)
ARTICLE
|
doi:10.20944/preprints202010.0224.v1
Subject:
Engineering,
Control And Systems Engineering
Keywords:
Remotely Piloted Aircraft Systems; RPAS; Unmanned Aerial Vehicles; UAV; Unmanned Aerial Systems; UAS; Detect and Avoid; DAA; Separation Assurance; Self Separation; Collision Avoidance; Situational Awareness; Drones; Aircraft; ADS-B; Real Time Simulations
Online: 12 October 2020 (10:31:56 CEST)