AI model accelerates defect-based material design

Across the physical world, many intricate structures form via symmetry breaking. When a system with inherent symmetry ...

Establishing a new QM/MM design principle based on electronic-state responses

The approach enables objective and automatic determination of the quantum-mechanical region based on electronic-state changes ...
Hosted on MSN

Photoshop tutorial: How to create a dynamic, split-colors logo

Photoshop cc 2014 tutorial showing how to design and create a custom, dynamic, split-colors logo comprised of off-registered color channels. Aldo the Apache Regular font: Dosis Book font: Royalty Free ...
C&EN

Combining Reactive Quantum-Mechanical Molecular-Dynamics Simulations with Mutagenesis, Crystallography, and Enzyme Kinetics to Reveal Plausible Steps of Isocyanide Hydratase ...

Creative Commons (CC): This is a Creative Commons license. Attribution (BY): Credit must be given to the creator. Non-Commercial (NC): Only non-commercial uses of the work are permitted. A complete ...
Frontiers

Molecular simulations of cavitation bubble dynamics

PoreLab, The Njord Centre, Department of Physics, University of Oslo, Oslo, Norway We study the cavitation bubble that forms as a nano-scale spherical surface is detached from a flat surface using ...
Scientific American

Single Atom Acts as a Quantum Computer and Simulates Molecules

A single atom has performed the first full quantum simulations of how certain molecules react to light. The researchers who carried out the feat say that their minimalistic approach could dramatically ...
Hosted on MSN

Gemini 2.5 Code particle simulations with dynamic motion

See how Gemini 2.5 Pro Experimental uses its reasoning capabilities to create an interactive simulation of a reflection nebula. FBI warns of 3-phase scam that is draining bank accounts “Christmas ...
IEEE

Computational Approaches to Molecular Dynamics Simulation for Drug Design and Discovery

Abstract: Since they offer profound insights into the atomic-level interactions between drug candidates and their biological targets, molecular dynamics (MD) simulations have become extremely ...
Geeky Gadgets

MS Excel: Dynamically Add Blank Rows for Perfect Data Clarity

Working with large datasets in Excel often presents challenges, particularly when clarity and organization are essential. Dynamically inserting blank rows between items is a highly effective method to ...
Scientific Research Publishing

Properties of Selenium under Tensile Stretch: A Molecular Dynamics Simulation ()

Selenium is the third element of the group of chalcogens and is especially used in electrotechnical applications. Since many manufacturing processes use thin films of the material, knowledge of the ...
Frontiers

Molecular dynamics simulation on the heat transfer at liquid-solid interfaces and enhancement mechanism

1 Department of Mechanical and Electrical Engineering, University of Shaoxing, Shaoxing, China 2 School of Energy and Power Engineering, Northeast Electric Power University, Jilin, China There has ...