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#molecular-modeling

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.

8 records
Tagged “molecular-modeling”Ranked by health index
PyPI
84Excellenthealth index
bradyajohnston/molecularnodes
Toolbox for molecular animations in Blender, powered by Geometry Nodes.
Python★ 1,317Jul 15, 2026
GPL-3.0Jul 15, 2026 · metrics 2.10.0
PyPI · npm
81Excellenthealth index
Acellera/moleculekit
MoleculeKit: Your favorite molecule manipulation kit
Python★ 237↓ 14.4K/moJul 24, 2026
Custom licenseJul 24, 2026 · metrics 2.10.0
PyPI
78Goodhealth index
elkins/synth-pdb
Generate realistic PDB files with mixed secondary structures for testing, education and bioinformatics tool development. Jupyter Notebook tutorials are available to visualize the concepts..
Python★ 1↓ 3,758/moJul 15, 2026
MITJul 15, 2026 · metrics 2.10.0
PyPI
78Goodhealth index
metatensor/metatomic
Atomistic machine learning models you can use everywhere for everything
Python · C · C++★ 47↓ 86/moAug 22, 2026
BSD-3-ClauseAug 22, 2026 · metrics 2.10.0
PyPI
71Goodhealth index
elkins-lab/synth-pdb
Generate realistic PDB files with mixed secondary structures for testing, education and bioinformatics tool development. Jupyter Notebook tutorials are available to visualize the concepts..
Python★ 1Jul 17, 2026
MITJul 17, 2026 · metrics 2.10.0
crates.io · PyPI
71Goodhealth index
molcrafts/molrs
[WIP] Molcrafts rust kernel
Rust★ 0↓ 76/moJul 15, 2026
BSD-3-ClauseJul 15, 2026 · metrics 2.10.0
PyPI
51Moderatehealth index
noahhenrikkleinschmidt/biobuild
A fragment-based molecular assembly toolkit
Python★ 51Jul 17, 2026
AGPL-3.0Jul 17, 2026 · metrics 2.10.0
npm
16Criticalhealth index
lukasturcani/mol-draw
A lightweight, 3D molecular viewer for JavaScript and PureScript applications.
PureScript · JavaScript★ 23↓ 115/moSep 5, 2026
Custom licenseSep 5, 2026 · metrics 2.10.0