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HDDFlyzer: High-Dimensional Descriptor-based Feature Space Analyzer

Authors: Contreras-Torres, Flavio F.; Saldivar-González, Fernanda I.;

HDDFlyzer: High-Dimensional Descriptor-based Feature Space Analyzer

Abstract

v0.1.5 (2026-06-15) HDDFlyzer is a pre-stable development prototype for a CLI-first cheminformatics toolkit with a Python API for reproducible, traceable molecular descriptor-space workflows. It generates descriptor, similarity, projection, and visualization outputs from compound collections, stores them with metadata, and supports later reconstruction, inspection, and analysis of completed runs.

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