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Name: Xiaohui Qu
Type: User
Name: Xiaohui Qu
Type: User
A simple, robust and flexible just-in-time job management framework in Python.
The drug screening effort relies on a number of data transformation steps as well as a bunch of calculations. This repo collects basic scripts that can be used to be accomplish these steps. At some point these scripts might mature to a point where they might find a better home in other repo in this organization.
The Fireworks Workflow Management Repo.
create a virtual environment for running FireWorks within Materials Project
merges pymatgen, custodian, and FireWorks into a custom workflow for Materials Project
The interactive graphing library for Python (includes Plotly Express) :sparkles:
Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.
Pymatgen-db provides an addon to the Python Materials Genomics (pymatgen) library (https://pypi.python.org/pypi/pymatgen) that allows the creation of Materials Project-style databases for management of materials data.
Cluster spectra with coarse grain constraint and disentangle chemical information automatically.
Workflow for Electrolyte Genome Project.
Calculation tools for X-ray absorption spectroscopy at NSLS-II
Semiempirical Extended Tight-Binding Program Package
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.