jpthompson17 Goto Github PK
Name: Jeff Thompson
Type: User
Company: OpenEye, Cadence Molecular Sciences
Location: Santa Fe, NM
Name: Jeff Thompson
Type: User
Company: OpenEye, Cadence Molecular Sciences
Location: Santa Fe, NM
An open tool implementing some recommended practices for analyzing alchemical free energy calculations
Free energy perturbation for LAMMPS.
Python library for analysis of time series data including dimensionality reduction, clustering, and Markov model estimation
Conversion tool for molecular simulations
An open library for the analysis of molecular dynamics trajectories
History-augmented Markov analysis of weighted ensemble trajectories.
Tool collection to integrate and mix OpenEye and OpenMM
OpenMM is a toolkit for molecular simulation using high performance GPU code.
Cubes and Floes for running MD on the OpenEye Cloud Computing Platform Orion
Amber parameter topology file editor
The Public Utility Data Liberation Project provides analysis-ready energy system data to climate advocates, researchers, policymakers, and journalists.
🚂 Python API for Emma's Markov Model Algorithms 🚂
Python implementation of the multistate Bennett acceptance ratio (MBAR)
Library for easily creating and using highly efficient, arbitrarily complex synthetic dynamics models
WESTPA: The Weighted Ensemble Simulation Toolkit with Parallelization and Analysis
Tutorials and additional documentation for the WESTPA 2.0. (For future LiveCoMS Tutorial Paper)
Tutorials and additional documentation for the WESTPA suite
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.