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Molecular structure and trajectory viewer built on PQAnalysis.

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PQ logo PQViewer

Inspect molecular structures, trajectories, and periodic geometry in a desktop browser.

SrTiO3 coordination polyhedra with the View inspector open

Start

Use Python 3.12 or newer and a browser with WebGL 2.

python3 -m venv .venv
source .venv/bin/activate
python -m pip install MolarVerse-PQViewer
pqviewer trajectory.xyz

Replace the path with your file, or try the three-frame water example.

Controls

Control Use
View Representations, layers, and periodic display
Analyze Atom properties, measurements, and trajectory plots
Export Figures and source-validated recipes

Follow the visual guide, or open the web demo. For cluster and home VPN use, follow Remote access.

PQViewer is in public beta; file and Python interfaces may change before 1.0. Release notes · Citation · Contributing · MIT License · Third-party notices

About

Molecular structure and trajectory viewer built on PQAnalysis.

Resources

Code of conduct

Contributing

Security policy

Stars

2 stars

Watchers

1 watching

Forks

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