Metadata-Version: 2.4
Name: almos_kit
Version: 1.1.0
Summary: Active Learning Molecular Selection
Home-page: https://github.com/MiguelMartzFdez/almos
Download-URL: https://github.com/MiguelMartzFdez/almos/archive/refs/tags/1.1.0.tar.gz
Author: Miguel Martínez Fernández, Susana García Abellán, David Dalmau Ginesta, Juan V. Alegre Requena
Author-email: miguel.martinez@csic.es, susanag.abellan@gmail.com
License: MIT
Keywords: workflows,machine learning,cheminformatics,clustering,active learning,automated
Classifier: Development Status :: 5 - Production/Stable
Classifier: Intended Audience :: Developers
Classifier: Topic :: Software Development :: Build Tools
Classifier: License :: OSI Approved :: MIT License
Classifier: Programming Language :: Python :: 3.11
Classifier: Programming Language :: Python :: 3.12
Classifier: Programming Language :: Python :: 3.13
Requires-Python: >=3.11
Description-Content-Type: text/markdown
License-File: LICENSE
Requires-Dist: aqme==2.0.0
Requires-Dist: robert==2.1.0
Requires-Dist: pandas==2.3.3
Requires-Dist: scipy<1.16,>=1.14
Requires-Dist: hdbscan<0.9,>=0.8.39
Requires-Dist: matplotlib<3.11,>=3.8
Requires-Dist: plotly<6.0,>=5.20
Requires-Dist: umap-learn<0.6,>=0.5.6
Requires-Dist: pca==2.0.9
Requires-Dist: kneed==0.8.5
Requires-Dist: pdfplumber==0.11.5
Requires-Dist: bayesian-optimization<4.0,>=3.0.0b1
Dynamic: author
Dynamic: author-email
Dynamic: classifier
Dynamic: description
Dynamic: description-content-type
Dynamic: download-url
Dynamic: home-page
Dynamic: keywords
Dynamic: license
Dynamic: license-file
Dynamic: requires-dist
Dynamic: requires-python
Dynamic: summary

Documentation in Read The Docs: https://almos.readthedocs.io
