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Name: Jeff Wagner
Type: User
Company: @openforcefield
Bio: Technical Lead at Open Force Field
Location: California
Name: Jeff Wagner
Type: User
Company: @openforcefield
Bio: Technical Lead at Open Force Field
Location: California
A conda-smithy repository for ambertools.
Conda development recipes (*-dev packages), built nightly by travis cron
A conda-smithy repository for conda-forge-repodata-patches.
conda build recipes for the Omnia project
Omnia conda recipes that require CUDA images to build
Python-centric Cookiecutter for Molecular Computational Chemistry Packages
Project to find pairs of homologous protein structures where an occupied binding site in one is closed in the other.
A tool for investigating labeled residues in homologous 3D protein strctures. Pre-loaded with APOBEC family information.
A conda-smithy repository for forcebalance.
A simple GitHub Action for creating cloud-based self-hosted runners.
Analysis of the LK99 replication attempt
A conda-smithy repository for openff-bespokefit.
A conda-smithy repository for openff-evaluator.
A conda-smithy repository for openff-forcefields.
A conda-smithy repository for openff-fragmenter.
A conda-smithy repository for openff-qcsubmit.
A conda-smithy repository for openff-toolkit.
A conda-smithy repository for openff-units.
Force fields produced by the Open Force Field Initiative
CHARMM and AMBER forcefields for OpenMM (with small molecule support)
The official sources for the RDKit library
Interface between ForceBalance and QCArchive
implementation of open-source version of RESP method
Rubik's cube simulator and solver, IPython/Jupyter
Tools used to generate the SciPy conference proceedings
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.