Open-source Codes (GitHub projects)

Contreras-Torres, F.F. (2025). NPSCORER: Toolkit to compute Natural Product-likeness (NPL) scores from SMILES with RDKit convention and visualize their distribution (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/npscorer 

Contreras-Torres, F.F. (2025). HARMONSMILE: Toolkit for aligns SMILES to the RDKit convention (canonical + isomeric + keculized) (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/harmonsmile 

Contreras-Torres, F.F. (2025). MOLRAPTOR: Modular Pipeline for Molecular Data Curation and Fingerprint Encoding (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/molraptor 

Contreras-Torres, F.F. (2025). CHAMANP: Curation and Hierarchical Analysis for Molecular Annotation of Natural Products (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/chamanp 

Contreras-Torres, F.F. (2025). MOSAIC: Modular Multi-model Selection & Cross-Validation (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/mosaic 

Contreras-Torres, F.F. (2025). TASSEL: Taxonomic Assignment of Scientific Semantic Labels (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/tassel 

Contreras-Torres, F.F. (2025). SPAACY: Abstract Validator (v.1.0). GitHub. https://github.com/NanoBiostructuresRG/spaacy-abstract-validator 

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