lilyminium Goto Github PK
Name: Lily Wang
Type: User
Company: @OpenForceField, @MDAnalysis
Bio: 🍜 She/her
Twitter: lilyminium
Location: Canberra, Australia
Name: Lily Wang
Type: User
Company: @OpenForceField, @MDAnalysis
Bio: 🍜 She/her
Twitter: lilyminium
Location: Canberra, Australia
Code for training PhysNet models
Parallel algorithms for MDAnalysis
Protein-Ligand Interaction Fingerprints
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
RESP with inter- and intra-molecular constraints in Psi4.
A conda-smithy repository for psiresp-split.
Data parsing and validation using Python type hints
A distributed compute and database platform for quantum chemistry.
A client interface to the QCArchive Project (read-only image of QCFractal)
Quantum Mechanical Bespoke Force Field Derivation Toolkit
The official sources for the RDKit library
A conda-smithy repository for rdkit_utilities.
Random odds and ends
Random snippets and small projects
Statistical data visualization using matplotlib
Set up your GitHub Actions workflow with a specific version of Python
Shell utilities for Zsh and Bash
Simple protein-ligand complex simulation with OpenMM
Differentiably evaluate energies using SMIRNOFF force fields
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
Make cute framed, centered text headers.
A tiny package to compute the dynamics of stochastic and molecular simulations
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.