Roberto Todeschini
Orcid: 0000-0002-6454-4192
According to our database1,
Roberto Todeschini
authored at least 25 papers
between 1991 and 2024.
Collaborative distances:
Collaborative distances:
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Bibliography
2024
Effectiveness of molecular fingerprints for exploring the chemical space of natural products.
J. Cheminformatics, December, 2024
2019
2016
Beware of Unreliable <i>Q</i><sup>2</sup>! A Comparative Study of Regression Metrics for Predictivity Assessment of QSAR Models.
J. Chem. Inf. Model., 2016
Mixtures, metabolites, ionic liquids: a new measure to evaluate similarity between complex chemical systems.
J. Cheminformatics, 2016
2015
N3 and BNN: Two New Similarity Based Classification Methods in Comparison with Other Classifiers.
J. Chem. Inf. Model., 2015
2013
Quantitative Structure-Activity Relationship Models for Ready Biodegradability of Chemicals.
J. Chem. Inf. Model., 2013
Defining a novel k-nearest neighbours approach to assess the applicability domain of a QSAR model for reliable predictions.
J. Cheminformatics, 2013
2012
Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets.
J. Chem. Inf. Model., 2012
2011
The <i>j</i>-index: a new bibliometric index and multivariate comparisons between other common indices.
Scientometrics, 2011
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information.
J. Cheminformatics, 2011
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information.
J. Comput. Aided Mol. Des., 2011
2010
Applicability Domains for Classification Problems: Benchmarking of Distance to Models for Ames Mutagenicity Set.
J. Chem. Inf. Model., 2010
2009
Comments on the Definition of the <i>Q</i><sup>2</sup> Parameter for QSAR Validation.
J. Chem. Inf. Model., 2009
2008
Critical Assessment of QSAR Models of Environmental Toxicity against <i>Tetrahymena pyriformis: </i> Focusing on Applicability Domain and Overfitting by Variable Selection.
J. Chem. Inf. Model., 2008
2006
Characterization of DNA Primary Sequences by a New Similarity/Diversity Measure Based on the Partial Ordering.
J. Chem. Inf. Model., 2006
2005
J. Comput. Aided Mol. Des., 2005
2002
Structure/Response Correlations and Similarity/Diversity Analysis by GETAWAY Descriptors, 2. Application of the Novel 3D Molecular Descriptors to QSAR/QSPR Studies.
J. Chem. Inf. Comput. Sci., 2002
Structure/Response Correlations and Similarity/Diversity Analysis by GETAWAY Descriptors, 1. Theory of the Novel 3D Molecular Descriptors.
J. Chem. Inf. Comput. Sci., 2002
1997
MS-WHIM, new 3D theoretical descriptors derived from molecular surface properties: A comparative 3D QSAR study in a series of steroids.
J. Comput. Aided Mol. Des., 1997
1994
A 3D QSAR approach to the search for geometrical similarity in a series of nonpeptide angiotensin II receptor antagonists.
J. Comput. Aided Mol. Des., 1994
The data analysis handbook.
Data handling in science and technology 14, North-Holland, ISBN: 978-0-444-81659-7, 1994
1992
Pharmacophore identification by molecular modeling and chemometrics: The case of HMG-CoA reductase inhibitors.
J. Comput. Aided Mol. Des., 1992
1991
Structure-activity relationship of Ca2+ channel blockers: A study using conformational analysis and chemometric methods.
J. Comput. Aided Mol. Des., 1991