nlesc-nano Goto Github PK
Name: Nanomaterial simulation packages
Type: Organization
Name: Nanomaterial simulation packages
Type: Organization
A package for performing assertions and providing informative exception messages.
A library for analyzing potential energy surfaces (PESs) and using the resulting PES descriptors for constructing forcefield parameters.
A repository with MD data used by the Auto-FOX tests
A collection of tools designed for the automatic construction, and subsequent analysis, of chemical compounds.
Web service to manage scientific simulation data
command-line interface to compute and molecular properties from a database
A package for converting CP2K input files into PLAMS-compatible dictionaries.
A databasing framework for the Compound Attachment Tools package (CAT).
A modular framework for neural networks with Euclidean symmetry
Computation and filtering of molecular properties
Unofficial mirror of the GMP repository
An unofficial redistribution of the Multipurpose Atom-Typer for CHARMM (MATCH) program
Collection of experiments predicting molecular properties with ML
A collection of tools for the analysis of nanocrystals.
Manylinux docker image with Nano-QMFlows C++ dependencies
Utility functions used throughout the various nlesc-nano repositories.
code for the SE3 Transformers paper: https://arxiv.org/abs/2006.10503
Statistical models to predict new materials
A collection of tutorials for the analysis of nanocrystals.
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.