QSAR-ME Profiler 2025: A New Software for QSA(P)R Predictions Supported by Structural Analysis
experiments. Over the past 20 years, QSA(P)Rs targeting various properties and activities have been developed by the QSAR research unit at the University of Insubria. The new software QSAR-ME Profiler 2025 streamlines the application of these and other QSA(P)Rs and simplifies the evaluation of the predictions. It provides transparent outputs in tabular and graphical form and innovative solutions, compared to similar software, to quantify prediction uncertainty and applicability domain, while supporting the analysis of structural similarity, the application of customized models, and the compilation of QSAR prediction reporting format.
Authors
- Nicola Chirico (ORCID: https://orcid.org/0009-0007-8686-8095)
- Ester Papa (ORCID: https://orcid.org/0000-0002-0041-556X)
- Marco Evangelista
- Arianna Sgariboldi
Institutions
- University of Insubria (IT)
Publication Details
- Journal
- Chemical Research in Toxicology
- Published
- 2026-04-22
- DOI
- https://doi.org/10.1021/acs.chemrestox.5c00552
- Primary Topic
- Computational Drug Discovery Methods
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- Ministero dell’Istruzione, dell’Università e della Ricerca