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Roberto Todeschini

Active 1989–2024

100
Papers
19,137
Citations
53
h-index
96
i10-index

Citations

Citations per year for Roberto Todeschini1983: 1 citations1985: 1 citations1988: 1 citations1990: 1 citations1992: 1 citations1993: 1 citations1994: 5 citations1995: 1 citations1996: 11 citations1997: 47 citations1998: 28 citations1999: 49 citations2000: 44 citations2001: 56 citations2002: 62 citations2003: 132 citations2004: 135 citations2005: 122 citations2006: 159 citations2007: 185 citations2008: 202 citations2009: 292 citations2010: 253 citations2011: 256 citations2012: 280 citations2013: 265 citations2014: 274 citations2015: 267 citations2016: 366 citations2017: 339 citations2018: 477 citations2019: 593 citations2020: 709 citations2021: 646 citations2022: 495 citations2023: 432 citations2024: 603 citations2025: 375 citations2026: 60 citations1984: no citations, so this year is not shown1986–1987: no citations, so these years are not shown1989: no citations, so this year is not shown1991: no citations, so this year is not shown

Citation sources

Countries

World map of the countries and regions citing this authorUnited States: 1,289 citing papers, 14.4% of this breakdownChina: 955 citing papers, 10.7% of this breakdownIndia: 496 citing papers, 5.5% of this breakdownItaly: 488 citing papers, 5.5% of this breakdownUnited Kingdom: 478 citing papers, 5.3% of this breakdownGermany: 425 citing papers, 4.7% of this breakdownSpain: 309 citing papers, 3.5% of this breakdownIran: 291 citing papers, 3.3% of this breakdownFrance: 225 citing papers, 2.5% of this breakdownSwitzerland: 183 citing papers, 2% of this breakdownCanada: 167 citing papers, 1.9% of this breakdownJapan: 164 citing papers, 1.8% of this breakdown
0%14.4%Other 38.9%

Institutions

Fields

  • Computer Science58.1%
  • Mathematics7.8%
  • Biochemistry, Genetics and Molecular Biology7.7%
  • Chemistry5.4%
  • Medicine5.1%
  • Materials Science3.5%
  • Other12.4%

Topics

  • Computational Drug Discovery Methods24.5%
  • Machine Learning in Materials Science4.8%
  • Analytical Chemistry and Chromatography4%
  • Graph theory and applications3.2%
  • Metabolomics and Mass Spectrometry Studies2.8%
  • Protein Structure and Dynamics2.2%
  • Other58.5%

Coauthors

All papers

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  1. QSAR Modeling: Where Have You Been? Where Are You Going To?

    Authors: Artem Cherkasov, Eugene Muratov, Denis Fourches, Alexandre Varnek, Igor I. Baskin, M Cronin, John C. Dearden, Paola Gramatica, Yvonne C. Martin, Roberto Todeschini, Viviana Consonni, V. Е. Kuz’min, Richard D. Cramer, Romualdo Benigni, Chihae Yang, James F. Rathman, Lothar Terfloth, Johann Gasteiger, Ann Richard, Alexander Tropsha - Journal of Medicinal Chemistry 2013 cited by 2,073

  2. Handbook of Molecular Descriptors

    Authors: Roberto Todeschini, Viviana Consonni - Methods and principles in medicinal chemistry 2000 cited by 4,137

  3. Comparison of Different Approaches to Define the Applicability Domain of QSAR Models

    Authors: Faizan Sahigara, Kamel Mansouri, Davide Ballabio, Andrea Mauri, Viviana Consonni, Roberto Todeschini - Molecules 2012 cited by 608

  4. Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information

    Authors: Iurii Sushko, Sergii Novotarskyi, Robert Körner, Anil Kumar Pandey, Matthias Rupp, Wolfram Teetz, Stefan Brandmaier, Ahmed Abdelaziz, Volodymyr V. Prokopenko, Vsevolod Yu. Tanchuk, Roberto Todeschini, Alexandre Varnek, Gilles Marcou, Peter Ertl, Vladimir Potemkin, Maria A. Grishina, Johann Gasteiger, Christof H. Schwab, Igor I. Baskin, Vladimir A. Palyulin, Eugene V. Radchenko, William J. Welsh, Vladyslav V. Kholodovych, Dmitriy Chekmarev, Artem Cherkasov, João Aires-de-Sousa, Qing-You Zhang, Andreas Bender, Florian Nigsch, Luc Patiny, Antony J. Williams, Valery Tkachenko, Igor V. Tetko - Journal of Computer-Aided Molecular Design, J. Comput. Aided Mol. Des. 2011 cited by 687

  5. Multivariate comparison of classification performance measures

    Authors: Davide Ballabio, Francesca Grisoni, Roberto Todeschini - Chemometrics and Intelligent Laboratory Systems 2017 cited by 320

  6. Comments on the Definition of the Q2 Parameter for QSAR Validation

    Authors: Viviana Consonni, Davide Ballabio, Roberto Todeschini - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2009 cited by 582

  7. Virtual Computational Chemistry Laboratory - Design and Description

    Authors: Igor V. Tetko, Johann Gasteiger, Roberto Todeschini, Andrea Mauri, David J. Livingstone, Peter Ertl, Vladimir A. Palyulin, Eugene V. Radchenko, Nikolai S. Zefirov, Alexander S. Makarenko, Vsevolod Yu. Tanchuk, Volodymyr V. Prokopenko - Journal of Computer-Aided Molecular Design, J. Comput. Aided Mol. Des. 2005 cited by 1,501

  8. Critical Assessment of QSAR Models of Environmental Toxicity against Tetrahymena pyriformis: Focusing on Applicability Domain and Overfitting by Variable Selection

    Authors: Igor V. Tetko, Iurii Sushko, Anil Kumar Pandey, Hao Zhu, Alexander Tropsha, Ester Papa, Tomas Öberg, Roberto Todeschini, Denis Fourches, Alexandre Varnek - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2008 cited by 412

  9. CATMoS: Collaborative Acute Toxicity Modeling Suite

    Authors: Kamel Mansouri, Agnes L. Karmaus, Jeremy Fitzpatrick, Grace Patlewicz, Prachi Pradeep, Domenico Alberga, Nathalie Alépée, Timothy E. H. Allen, Dave Allen, Vinícius M. Alves, Carolina Horta Andrade, Tyler R. Auernhammer, Davide Ballabio, Shannon Bell, Emilio Benfenati, Sudin Bhattacharya, Joyce V. Bastos, Stephen A. Boyd, J.B. Brown, Stephen J. Capuzzi, Yaroslav Chushak, Heather L. Ciallella, Alex M. Clark, Viviana Consonni, Pankaj Daga, Sean Ekins, Sherif S. Farag, Maxim V. Fedorov, Denis Fourches, Domenico Gadaleta, Feng Gao, Jeffery M. Gearhart, Garett Goh, Jonathan M. Goodman, Francesca Grisoni, Chris Grulke, Thomas Härtung, Matthew Hirn, Pavel Karpov, Alexandru Korotcov, Giovanna J. Lavado, Michael S. Lawless, Xinhao Li, Thomas Luechtefeld, Filippo Lunghini, Giuseppe Felice Mangiatordi, Gilles Marcou, Dan H. Marsh, Todd M. Martin, Andrea Mauri, Eugene Muratov, Glenn J. Myatt, Ðắc-Trung Nguyễn, Orazio Nicolotti, Reine Note, Paritosh Pande, Amanda K. Parks, Tyler Peryea, Ahsan Habib Polash, Robert Ralló, Alessandra Roncaglioni, Craig Rowlands, Patricia Ruiz, Daniel P. Russo, Ahmed E Sayed, Risa Sayre, Timothy Sheils, Charles Siegel, Arthur C. Silva, Anton Simeonov, Sergey Sosnin, Noel Southall, Judy Strickland, Yun Tang, Brian J. Teppen, Igor V. Tetko, Dennis Thomas, Valery Tkachenko, Roberto Todeschini, Cosimo Toma, Ignacio J. Tripodi, Daniela Trisciuzzi, Alexander Tropsha, Alexandre Varnek, Kristijan Vuković, Zhongyu Wang, Liguo Wang, Katrina M. Waters, Andrew J. Wedlake, Sanjeeva J. Wijeyesakere, Dan Wilson, Zijun Xiao, Hongbin Yang, Gergely Zahoránszky-Köhalmi, Alexey Zakharov, Fagen F. Zhang, Zhen Zhang, Tongan Zhao, Hao Zhu, Kimberley M. Zorn and 2 more - Environmental Health Perspectives 2021 cited by 141

  10. CERAPP: Collaborative Estrogen Receptor Activity Prediction Project

    Authors: Kamel Mansouri, Ahmed Abdelaziz, Aleksandra Rybacka, Alessandra Roncaglioni, Alexander Tropsha, Alexandre Varnek, Alexey Zakharov, Andrew Worth, Ann M. Richard, Chris Grulke, Daniela Trisciuzzi, Denis Fourches, Dragos Horvath, Emilio Benfenati, Eugene Muratov, Eva Bay Wedebye, Francesca Grisoni, Giuseppe Felice Mangiatordi, Giuseppina Maria Incisivo, Huixiao Hong, Hui Wen Ng, Igor V. Tetko, Ilya A. Balabin, Jayaram Kancherla, Jie Shen, J. S. Burton, Marc C. Nicklaus, Matteo Cassotti, Nikolai Georgiev Nikolov, Orazio Nicolotti, Patrik L. Andersson, Qingda Zang, Regina Politi, Richard D. Beger, Roberto Todeschini, Ruili Huang, Sherif S. Farag, Sine Abildgaard Rosenberg, Svetoslav Slavov, Xin Hu, Richard Judson - Environmental Health Perspectives 2016 cited by 372

  11. Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets

    Authors: Roberto Todeschini, Viviana Consonni, Hua Xiang, John D. Holliday, Paolo Massimo Buscema, Peter Willett - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2012 cited by 234

  12. CoMPARA: Collaborative Modeling Project for Androgen Receptor Activity

    Authors: Kamel Mansouri, Nicole Kleinstreuer, Ahmed M. Abdelaziz, Domenico Alberga, Vinícius M. Alves, Patrik L. Andersson, Carolina Horta Andrade, Fang Bai, Ilya A. Balabin, Davide Ballabio, Emilio Benfenati, Barun Bhhatarai, Scott Boyer, Jingwen Chen, Viviana Consonni, Sherif S. Farag, Denis Fourches, Alfonso T. García‐Sosa, Paola Gramatica, Francesca Grisoni, Chris Grulke, Huixiao Hong, Dragos Horvath, Xin Hu, Ruili Huang, Nina Jeliazkova, Jiazhong Li, Xuehua Li, Huanxiang Liu, Serena Manganelli, Giuseppe Felice Mangiatordi, Uko Maran, Gilles Marcou, Todd M. Martin, Eugene Muratov, Ðắc-Trung Nguyễn, Orazio Nicolotti, Nikolai Georgiev Nikolov, Ulf Norinder, Ester Papa, Michel Petitjean, Geven Piir, Pavel V. Pogodin, Vladimir Poroikov, Xianliang Qiao, Ann M. Richard, Alessandra Roncaglioni, Patricia Ruiz, Chetan Rupakheti, Sugunadevi Sakkiah, Alessandro Sangion, Karl‐Werner Schramm, Chandrabose Selvaraj, Imran Shah, Sulev Sild, Lixia Sun, Olivier Taboureau, Yun Tang, Igor V. Tetko, Roberto Todeschini, Weida Tong, Daniela Trisciuzzi, Alexander Tropsha, George A. Van Den Driessche, Alexandre Varnek, Zhongyu Wang, Eva Bay Wedebye, Antony Williams, Hong‐Bin Xie, Alexey Zakharov, Ziye Zheng, Richard Judson - Environmental Health Perspectives 2020 cited by 214

  13. Applicability Domains for Classification Problems: Benchmarking of Distance to Models for Ames Mutagenicity Set

    Authors: Iurii Sushko, Sergii Novotarskyi, Robert Körner, Anil Kumar Pandey, Artem Cherkasov, Jiazhong Li, Paola Gramatica, Katja Hansen, Timon Schroeter, Klaus-Robert Müller, Lili Xi, Huanxiang Liu, Xiaojun Yao, Tomas Öberg, Farhad Hormozdiari, Phuong Dao, Süleyman Cenk Sahinalp, Roberto Todeschini, Pavel G. Polishchuk, Anatoly G. Artemenko, Victor Kuzmin, Todd M. Martin, Douglas M. Young, Denis Fourches, Eugene N. Muratov, Alexander Tropsha, Igor I. Baskin, Dragos Horvath, Gilles Marcou, Christophe Muller, Alexandre Varnek, Volodymyr V. Prokopenko, Igor V. Tetko - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2010 cited by 259

  14. DRAGON SOFTWARE: AN EASY APPROACH TO MOLECULAR DESCRIPTOR CALCULATIONS

    Authors: Andrea Mauri, Viviana Consonni, Manuela Pavan, Roberto Todeschini, Milano Chemometrics - 2006 cited by 508

  15. Classification-based machine learning approaches to predict the taste of molecules: A review

    Authors: Cristian Rojas, Davide Ballabio, Viviana Consonni, Diego Suárez‐Estrella, Roberto Todeschini - Food Research International 2023 cited by 39

  16. Impact of Molecular Descriptors on Computational Models

    Authors: Francesca Grisoni, Viviana Consonni, Roberto Todeschini - Methods in molecular biology 2018 cited by 73

  17. Molecular Descriptors

    Authors: Viviana Consonni, Roberto Todeschini - Challenges and advances in computational chemistry and physics 2009 cited by 121

  18. Extended multivariate comparison of 68 cluster validity indices. A review

    Authors: Roberto Todeschini, Davide Ballabio, Veronica Termopoli, Viviana Consonni - Chemometrics and Intelligent Laboratory Systems 2024 cited by 39

  19. Quantitative Structure-Activity Relationship Models for Ready Biodegradability of Chemicals

    Authors: Kamel Mansouri, Tine Ringsted, Davide Ballabio, Roberto Todeschini, Viviana Consonni - Journal of Chemical Information and Modeling, J. Chem. Inf. Model. 2013 cited by 221

  20. Molecular Descriptors for Chemoinformatics : Volume I : Alphabetical Listing / Volume II : Appendices, References

    Authors: Roberto Todeschini, Viviana Consonni - 2009 cited by 143

  21. A similarity-based QSAR model for predicting acute toxicity towards the fathead minnow (Pimephales promelas)

    Authors: Matteo Cassotti, Davide Ballabio, Roberto Todeschini, Viviana Consonni - SAR and QSAR in environmental research 2015 cited by 85

  22. Defining a novel k-nearest neighbours approach to assess the applicability domain of a QSAR model for reliable predictions

    Authors: Faizan Sahigara, Davide Ballabio, Roberto Todeschini, Viviana Consonni - Journal of Cheminformatics, J. Cheminformatics 2013 cited by 108

  23. Molecular Descriptors for Structure–Activity Applications: A Hands-On Approach

    Authors: Francesca Grisoni, Davide Ballabio, Roberto Todeschini, Viviana Consonni - Methods in molecular biology 2018 cited by 83

  24. Evaluation of model predictive ability by external validation techniques

    Authors: Viviana Consonni, Davide Ballabio, Roberto Todeschini - Journal of Chemometrics 2010 cited by 362