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Simmate is a full-stack framework for chemistry research.

copied from cf-post-staging / simmate

Installers

Info: This package contains files in non-standard labels.
  • noarch v0.18.0

conda install

To install this package run one of the following:
conda install conda-forge::simmate
conda install conda-forge/label/simmate_dev::simmate

Description

Simmate is a full-stack framework for chemistry research. It helps you calculate properties and explore third-party databases for both for molecular and crystalline systems. For experts, it also provides a toolbox to build out your own chemistry applications.


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