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#molecular-simulation

Every repository in the public record carrying this tag — from its GitHub topics or the keywords its package registries publish. Health is measured under the same versioned methodology as the rest of the record.

2 records
Tagged “molecular-simulation”Ranked by health index
PyPI
81Goodhealth index
MDAnalysis/mdanalysis
MDAnalysis is a Python library to analyze molecular dynamics simulations.
Python★ 1,610↓ 219.6K/moJul 21, 2026
Custom licenseJul 21, 2026 · metrics 1.13.0
PyPI
77Goodhealth index
mosdef-hub/mbuild
A hierarchical, component based molecule builder
Python★ 221↓ 3,105/moJul 20, 2026
Custom licenseJul 20, 2026 · metrics 1.13.0