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denoptim-project / packages

Package Name Access Summary Updated
autocompchem public Package for automation of computational chemistry tasks. 2025-08-12
denoptim public Package for de novo design and virtual screening of functional molecules of any kind. 2025-05-20
dnptools public Python utilities for working with DENOPTIM (https://github.com/denoptim-project/DENOPTIM) 2025-03-25

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