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)
COMMUNICATION
|
doi:10.20944/preprints202104.0524.v1
Subject:
Chemistry And Materials Science,
Biomaterials
Keywords:
machine learning; Gaussian; nanoparticles; descriptors; docking; simulations; PLGA
Online: 20 April 2021 (09:47:24 CEST)
ARTICLE
|
doi:10.20944/preprints202104.0350.v1
Subject:
Physical Sciences,
Acoustics
Keywords:
Singularity; 2-Time dimensions; Simulations; Big Bang; Entanglement; Entropy; Mandela Effect; Eternal Inflation; Multiverse
Online: 13 April 2021 (11:47:13 CEST)
ARTICLE
|
doi:10.20944/preprints202104.0026.v1
Subject:
Biology And Life Sciences,
Biochemistry And Molecular Biology
Keywords:
chloramphenicol; alkyl(triphenyl)phosphonium; bacterial ribosome; molecular dynamics simulations; antibiotic activity; antiproliferative activity
Online: 1 April 2021 (14:38:19 CEST)
ARTICLE
|
doi:10.20944/preprints202102.0171.v1
Subject:
Chemistry And Materials Science,
Theoretical Chemistry
Keywords:
P–fertility, orthophosphate, glycerolphosphate, inositolhexaphosphate, goethite, adsorption, surface complexation, MD simulations, QMMM
Online: 8 February 2021 (07:43:53 CET)
ARTICLE
Subject:
Engineering,
Automotive Engineering
Keywords:
Particle method; Smoothed particle hydrodynamics; Modeling; Simulations; Shock wave
Online: 12 January 2021 (15:55:50 CET)
REVIEW
|
doi:10.20944/preprints202010.0394.v2
Subject:
Environmental And Earth Sciences,
Atmospheric Science And Meteorology
Keywords:
Tsunami Modeling; Tsunami Simulations; Numerical Methods
Online: 18 December 2020 (12:01:05 CET)
ARTICLE
|
doi:10.20944/preprints202012.0326.v1
Subject:
Physical Sciences,
Condensed Matter Physics
Keywords:
Shape memory polymers; Size effect of additives; Molecular dynamics simulations
Online: 14 December 2020 (12:02:39 CET)
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)
TECHNICAL NOTE
|
doi:10.20944/preprints202010.0340.v1
Subject:
Physical Sciences,
Acoustics
Keywords:
celestial mechanics; three-body problem; gravitational interaction; chaos; orbits; astronomical simulations
Online: 16 October 2020 (08:25:00 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)
REVIEW
|
doi:10.20944/preprints202009.0556.v1
Subject:
Engineering,
Mechanical Engineering
Keywords:
urban flows; coherent structures; experiments; simulations; data-driven methods
Online: 23 September 2020 (17:45:58 CEST)
ARTICLE
Subject:
Physical Sciences,
Nuclear And High Energy Physics
Keywords:
timing detectors; detector modelling and simulations
Online: 26 August 2020 (03:59:12 CEST)
ARTICLE
|
doi:10.20944/preprints202008.0200.v1
Subject:
Chemistry And Materials Science,
Metals, Alloys And Metallurgy
Keywords:
oxide glasses; strength; ductility; work hardening ability; nanoscale heterogeneities; molecular dynamics simulations
Online: 8 August 2020 (03:15:33 CEST)
ARTICLE
|
doi:10.20944/preprints202008.0189.v1
Subject:
Physical Sciences,
Applied Physics
Keywords:
Neural networks, Nonlinear Dynamical Systems, Pattern Recognition, Numerical Simulations
Online: 7 August 2020 (11:25:33 CEST)
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/preprints202006.0052.v1
Subject:
Engineering,
Mechanical Engineering
Keywords:
Cyclic indentation; Vickers hardness; inverse analysis; numerical simulations; cyclic material properties; fatigue life
Online: 5 June 2020 (14:17:27 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/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/preprints202004.0140.v1
Subject:
Computer Science And Mathematics,
Analysis
Keywords:
mathematical models; coronavirus; caputo-fabrizio derivative; basic reproduction number; existence and stability; numerical simulations
Online: 9 April 2020 (08:12:53 CEST)
ARTICLE
|
doi:10.20944/preprints202002.0308.v1
Subject:
Medicine And Pharmacology,
Pharmacology And Toxicology
Keywords:
SARS-CoV-2; COVID-19; 3CL protease; molecular docking; molecular dynamics and simulations
Online: 23 February 2020 (02:17:46 CET)
REVIEW
Subject:
Chemistry And Materials Science,
Other
Keywords:
chiroptical systems; theoretical simulations, chiral design; sensing applications
Online: 30 January 2020 (12:28:25 CET)
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/preprints201912.0105.v1
Subject:
Physical Sciences,
Condensed Matter Physics
Keywords:
coarsening; deswelling; microgels; soft nanoparticles; simulations
Online: 8 December 2019 (17:38:30 CET)
ARTICLE
|
doi:10.20944/preprints201911.0139.v1
Subject:
Chemistry And Materials Science,
Physical Chemistry
Keywords:
azobenzenes; self-assembly; cooperativity; hydrogen bonding; computer simulations
Online: 13 November 2019 (03:34:24 CET)
ARTICLE
|
doi:10.20944/preprints201909.0080.v1
Subject:
Engineering,
Electrical And Electronic Engineering
Keywords:
photo-voltaic; monocrystalline; energy efficiency; hot-arid climate; smart cities; MATLAB simulations
Online: 7 September 2019 (00:40:23 CEST)
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/preprints201907.0266.v1
Subject:
Environmental And Earth Sciences,
Oceanography
Keywords:
HYCOM; OpenDrift; OpenOil; oil spill; modelling; simulations; satellite; observations; river fronts; DeepWater Horizon
Online: 24 July 2019 (08:34:51 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/preprints201901.0241.v1
Subject:
Engineering,
Civil Engineering
Keywords:
energy piles; validation; floor slab heat loss; energy; computer simulations
Online: 23 January 2019 (14:04:51 CET)
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)
REVIEW
|
doi:10.20944/preprints201812.0193.v1
Subject:
Biology And Life Sciences,
Biophysics
Keywords:
coarse-grained; CABS model; MC simulations; statistical force fields; disordered protein; protein structure
Online: 17 December 2018 (10:54:32 CET)
ARTICLE
|
doi:10.20944/preprints201809.0142.v3
Subject:
Engineering,
Civil Engineering
Keywords:
radiator efficiency; energy; operative temperature; analytical model; computer simulations
Online: 5 December 2018 (12:44:58 CET)
REVIEW
|
doi:10.20944/preprints201810.0653.v3
Subject:
Chemistry And Materials Science,
Theoretical Chemistry
Keywords:
automated algorithm; molecular dynamics; graph theory; statistical rate theory; kinetics simulations
Online: 2 December 2018 (09:39:19 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/preprints201810.0534.v1
Subject:
Engineering,
Industrial And Manufacturing Engineering
Keywords:
non-destructive testing; process optimization; porosity; pore hotspots; image-based simulations; 3D image analysis
Online: 23 October 2018 (09:58:18 CEST)
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/preprints201807.0356.v1
Subject:
Physical Sciences,
Biophysics
Keywords:
Anomalous diffusion; FRAP; Numerical Simulations; PH -domain, Membrane Binding
Online: 19 July 2018 (11:17:03 CEST)
ARTICLE
|
doi:10.20944/preprints201807.0150.v1
Subject:
Engineering,
Other
Keywords:
Transient models; Simulations; Natural Gas; Pipeline; Finite Element Method; Ansys Flotran
Online: 9 July 2018 (14:03:19 CEST)
ARTICLE
|
doi:10.20944/preprints201806.0423.v1
Subject:
Physical Sciences,
Atomic And Molecular Physics
Keywords:
DFT; periodic simulations; amorphous minerals; physico-chemical properties; super-cell
Online: 26 June 2018 (13:10:49 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/preprints201806.0039.v1
Subject:
Engineering,
Bioengineering
Keywords:
Protein A; Heptapeptide; M13 Phage-Display; ELISA; Fc; purification; docking; molecular dynamics simulations
Online: 4 June 2018 (12:03:52 CEST)
ARTICLE
|
doi:10.20944/preprints201805.0155.v1
Subject:
Physical Sciences,
Mathematical Physics
Keywords:
monte-carlo simulations; burgers equation; langevin equation; fractional velocity
Online: 10 May 2018 (06:11:01 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/preprints201801.0069.v1
Subject:
Chemistry And Materials Science,
Theoretical Chemistry
Keywords:
meta-aminobenzoic acid; solvation; aggregation; polymorphism; atomistic simulations
Online: 8 January 2018 (12:12:25 CET)
ARTICLE
|
doi:10.20944/preprints201711.0111.v1
Subject:
Environmental And Earth Sciences,
Environmental Science
Keywords:
SWAT; ArcGIS; simulations scenarios; sediment yield
Online: 16 November 2017 (17:53:56 CET)
ARTICLE
|
doi:10.20944/preprints201710.0129.v1
Subject:
Engineering,
Civil Engineering
Keywords:
hydropower; errors; multi-step ahead forecasting; recursive method; simulations
Online: 19 October 2017 (02:34:27 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/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)
ARTICLE
|
doi:10.20944/preprints201612.0057.v1
Subject:
Physical Sciences,
Astronomy And Astrophysics
Keywords:
galaxies; clusters; general; methods N-body simulations; cosmology; theory
Online: 9 December 2016 (16:38:17 CET)
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)