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Chemiscope

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Chemiscope

Free

Free and open source · BSD 3-Clause license

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On the record

Atom data
The structure viewer can color atoms by atomic properties and display additional data such as force vectors and tensor ellipsoids.chemiscope.org · read 11 Oct 2026
Dashboard type
interactivechemiscope.org · read 23 Sep 2026
Embedding
Chemiscope can be embedded as a component in Streamlit applications and in Sphinx or Sphinx-Gallery documentation.chemiscope.org · read 11 Oct 2026
Integrations
The notebook widget works in Jupyter, JupyterLab, VS Code, marimo, and Google Colab without a separate frontend extension installation.chemiscope.org · read 11 Oct 2026
Large-map limit
For datasets with more than 50,000 points, adaptive resolution displays only a subset while zoomed out and adds points as the user zooms in.chemiscope.org · read 11 Oct 2026
License and audience
Chemiscope is free and open source under the BSD license, and is presented for research and software projects involving materials and molecules.chemiscope.org · read 11 Oct 2026
Offline limitation
The standalone HTML visualizer supports JSON files but not compressed JSON files ending in .json.gz.chemiscope.org · read 11 Oct 2026
Platform
webchemiscope.org · read 23 Sep 2026
Property display
Properties can be mapped to plot axes, color, and point size; users can select points to show corresponding structures and vice versa.chemiscope.org · read 11 Oct 2026
Purpose
Chemiscope interactively explores materials and molecular databases to help researchers find structure-property correlations.chemiscope.org · read 11 Oct 2026
Python
The Python package creates Chemiscope JSON inputs and provides functions to show datasets interactively in notebooks.chemiscope.org · read 11 Oct 2026
Scale
The documentation says Chemiscope is designed for databases of up to hundreds of thousands of structures, with dynamic structure loading and plot resampling.chemiscope.org · read 11 Oct 2026
Security
The opened official pages do not state security certifications, compliance claims, or a security policy.chemiscope.org · read 11 Oct 2026
Sharing
Users can share datasets as JSON files, load them from public URLs in the online viewer, or distribute an offline standalone HTML visualizer.chemiscope.org · read 11 Oct 2026
Support
The project README directs users to open a GitHub issue or email the developers for help.github.com · read 11 Oct 2026
Visualization
It combines a 3D chemical structure viewer with an interactive 2D or 3D scatter plot of associated properties.chemiscope.org · read 11 Oct 2026

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