Results 21 to 30 of about 3,784,520 (317)

Friction between Iron and Partially Frozen Graphite Nanoparticles

Tribology Online, 2023
This study uses the molecular dynamics simulations to investigate the friction between the iron plate sliding against the partially frozen graphite nanoparticle. The graphite nanoparticle is divided into the two parts along the normal direction: the part
Le Van Sang
doaj   +1 more source

Molecular Docking and Molecular Dynamic Simulation of 1,5-Benzothiazepine Chalcone Derivative Compounds as Potential Inhibitors for Zika Virus Helicase

Jurnal Riset Kimia, 2021
Zika virus caused of the emerging infections characterized by fever, Guillain-Barré syndrome (GBS) for adults. In the current work, we aimed to study the binding orientation of 1,5-benzothiazepine compounds as new potential agent against Zika virus ...
Neni Frimayanti, Musyirna Rahmah Nasution, Elsa Etavianti   +2 more
doaj   +1 more source

Frederick Ames, MD, Oral History Interview, The First 50 Years of Surgery at MD Anderson (1945 – 1995), February 27, 2019 [PDF]

, 2019
Major Topics Covered: Medical training, military service Surgery at MD Anderson in the mid-late seventies to early nineties: practice of general surgery; conservatism and innovation; from general surgery to surgical oncology The division system ...
Balch, Charles M., MD, Ames, Frederick, MD, Rosolowski, Tacey A., PhD   +2 more
core  

Prospecting the protein design landscape

FEBS Letters, EarlyView.
This review outlines the current state of various protein design approaches. We discuss the current possibilities enabled by recently released tools, highlight future avenues to pursue in protein design, and underscore the crucial role of key databases and resources for successful protein design workflows.
Jakob R. Riccabona, Katharina T. Stonig, Jens Meiler, Clara T. Schoeder, Monica L. Fernández‐Quintero   +4 more
wiley   +1 more source

Unlocking the Potential of Papuan Red Fruit (Pandanus conoideus Lamk): A Comprehensive Exploration of Its Role in COVID-19 Inhibition Through Molecular Docking and Molecular Dynamics Simulation

Indonesian Journal of Chemistry
Indonesia's rich flora has long been used in traditional herbal medicine, and scientific research is now confirming the health benefits of these plants.
Agus Dwi Ananto, Harno Dwi Pranowo, Winarto Haryadi, Niko Prasetyo   +3 more
doaj   +1 more source

Combination of coarse-grained molecular dynamics simulations and small-angle X-ray scattering experiments

Biophysics and Physicobiology, 2019
The combination of molecular dynamics (MD) simulations and small-angle X-ray scattering (SAXS), called the MD-SAXS method, is efficient for investigating protein dynamics.
Toru Ekimoto, Yuichi Kokabu, Tomotaka Oroguchi, Mitsunori Ikeguchi   +3 more
doaj   +1 more source

Supporting MD Anderson\u27s Values [PDF]

, 2012
oai:openworks.mdanderson.org:historicalvideos-1002In this clip, Dr. John Mendelsohn talks to Dr. Tacey Ann Rosolowski about embracing MD Anderson\u27s core values: integrity, caring, and discovery.
Mendelsohn, John, MD, Rosolowski, Tacey A., PhD   +1 more
core  

Invisible but not inaccessible—Revealing transient oligomers formed by intrinsically disordered proteins with solution NMR and complementary methods

FEBS Letters, EarlyView.
Transient oligomers formed by intrinsically disordered proteins may be ‘invisible’ to direct detection yet remain accessible to solution NMR through equilibrium‐exchange measurements and pressure‐jump experiments. Complementary methods report on mass, stoichiometry, selected distance distributions, morphology, and internal packing.
Martin D. Gelenter, Ad Bax
wiley   +1 more source

An Overview of Molecular Dynamic Simulation for Corrosion Inhibition of Ferrous Metals

Metals, 2020
Molecular dynamics (MD) simulation is a powerful tool to study the molecular level working mechanism of corrosion inhibitors in mitigating corrosion. In the past decades, MD simulation has emerged as an instrument to investigate the interactions at the ...
Nur Izzah Nabilah Haris, Shafreeza Sobri, Yus Aniza Yusof, Nur Kartinee Kassim   +3 more
doaj   +1 more source

Effect of lubricants on the rotational transmission between solid-state gears

Beilstein Journal of Nanotechnology, 2022
Lubricants are widely used in macroscopic mechanical systems to reduce friction and wear. However, on the microscopic scale, it is not clear to what extent lubricants are beneficial.
Huang-Hsiang Lin, Jonathan Heinze, Alexander Croy, Rafael Gutiérrez, Gianaurelio Cuniberti   +4 more
doaj   +1 more source