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delfin-complat

DELFIN is a modular computational chemistry platform that automates end-to-end molecular workflows — from SMILES input to realistic property predictions. It combines structure generation, DFT, semi-empirical methods, ML potentials, and AI tools behind a unified interface with an interactive browser-based dashboard.

Ecosystem
pypi.org
Latest Release
1.1.12
7 months ago
Versions
21
Downloads
83 last month
Links
Registry pypi.org
Source Repository
Docs Documentation
JSON API View JSON
CodeMeta codemeta.json
Package Details
PURL pkg:pypi/delfin-complat
spec
License LGPL-3.0-or-later
First Release about 1 year ago
Last Synced 7 days ago
Repository
Stars 9 on GitHub
Forks 2 on GitHub