xijunw Goto Github PK
Name: Xijun Wang (Alvin)
Type: User
Company: DeepVisual Canada Inc.
Bio: Researcher in Computational Chemistry, Creator of DeepVisual Canada Inc, and Unibox Software for molecular simulation.
Location: Vancouver, Canada
Name: Xijun Wang (Alvin)
Type: User
Company: DeepVisual Canada Inc.
Bio: Researcher in Computational Chemistry, Creator of DeepVisual Canada Inc, and Unibox Software for molecular simulation.
Location: Vancouver, Canada
Avogadro is an advanced molecular editor designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible rendering and a powerful plugin architecture.
Quantum chemistry and solid state physics software package
Several QM/MM tutorials for biological simulations adapted to CP2K. Tutorials adapted from AMBER, GMX, NAMD and CPMD softwares.
The CPMD code is a parallelized plane wave / pseudopotential implementation of Density Functional Theory, particularly designed for ab-initio molecular dynamics.
Car-Parrinello method
Generate CPMD input file from json
DFTB+ general package for performing fast atomistic simulations
Google Chrome, Firefox, and Thunderbird extension that lets you write email in Markdown and render it before sending.
Performa molecular dynamics simulation with energy and force evaluated through gaussian software
The Molecular Modelling Toolkit
The code of MolView.org
NAMD-xtb-QMMM-interface
Opencore configuration for Catalina
OpenMM is a toolkit for molecular simulation using high performance GPU code.
pwtools is a Python package for pre- and postprocessing of atomistic calculations, mostly targeted to Quantum Espresso, CPMD, CP2K and LAMMPS. It is almost, but not quite, entirely unlike ASE, with some tools extending numpy/scipy. It has a set of powerful parsers and data types for storing calculation data.
Solutions for Modern Quantum Chemistry, Szabo & Ostlund
Template based molecular modeling platform
《现代量子化学》汉化版
A declarative, efficient, and flexible JavaScript library for building user interfaces.
🖖 Vue.js is a progressive, incrementally-adoptable JavaScript framework for building UI on the web.
TypeScript is a superset of JavaScript that compiles to clean JavaScript output.
An Open Source Machine Learning Framework for Everyone
The Web framework for perfectionists with deadlines.
A PHP framework for web artisans
Bring data to life with SVG, Canvas and HTML. 📊📈🎉
JavaScript (JS) is a lightweight interpreted programming language with first-class functions.
Some thing interesting about web. New door for the world.
A server is a program made to process requests and deliver data to clients.
Machine learning is a way of modeling and interpreting data that allows a piece of software to respond intelligently.
Some thing interesting about visualization, use data art
Some thing interesting about game, make everyone happy.
We are working to build community through open source technology. NB: members must have two-factor auth.
Open source projects and samples from Microsoft.
Google ❤️ Open Source for everyone.
Alibaba Open Source for everyone
Data-Driven Documents codes.
China tencent open source team.