Handbook of molecular descriptors R Todeschini, V Consonni Wiley-VCH, pp. 668, 2000 | 5873* | 2000 |
Molecular descriptors for chemoinformatics. (2 volumes) R Todeschini, V Consonni Wiley-VCH, pp. 1257, 2009 | 2372* | 2009 |
QSAR modeling: where have you been? Where are you going to? A Cherkasov, EN Muratov, D Fourches, A Varnek, II Baskin, M Cronin, ... Journal of medicinal chemistry 57 (12), 4977-5010, 2014 | 2038 | 2014 |
Virtual computational chemistry laboratory–design and description IV Tetko, J Gasteiger, R Todeschini, A Mauri, D Livingstone, P Ertl, ... Journal of computer-aided molecular design 19, 453-463, 2005 | 1814 | 2005 |
Dragon software: An easy approach to molecular descriptor calculations A Mauri, V Consonni, M Pavan, R Todeschini MATCH Commun. Math. Comput. Chem. 56 (2), 237-248, 2006 | 724 | 2006 |
Online chemical modeling environment (OCHEM): web platform for data storage, model development and publishing of chemical information I Sushko, S Novotarskyi, R Körner, AK Pandey, M Rupp, W Teetz, ... Journal of computer-aided molecular design 25, 533-554, 2011 | 651 | 2011 |
Comments on the definition of the Q2 parameter for QSAR validation V Consonni, D Ballabio, R Todeschini Journal of chemical information and modeling 49 (7), 1669-1678, 2009 | 649 | 2009 |
Structure/response correlations and similarity/diversity analysis by GETAWAY descriptors. 1. Theory of the novel 3D molecular descriptors V Consonni, R Todeschini, M Pavan Journal of chemical information and computer sciences 42 (3), 682-692, 2002 | 584 | 2002 |
Comparison of different approaches to define the applicability domain of QSAR models F Sahigara, K Mansouri, D Ballabio, A Mauri, V Consonni, R Todeschini Molecules 17 (5), 4791-4810, 2012 | 525 | 2012 |
The data analysis handbook IE Frank, R Todeschini Elsevier, pp. 366, 1994 | 488 | 1994 |
Critical Assessment of QSAR Models of Environmental Toxicity against Tetrahymena pyriformis: Focusing on Applicability Domain and Overfitting by Variable … IV Tetko, I Sushko, AK Pandey, H Zhu, A Tropsha, E Papa, T Oberg, ... Journal of chemical information and modeling 48 (9), 1733-1746, 2008 | 459 | 2008 |
Evaluation of model predictive ability by external validation techniques V Consonni, D Ballabio, R Todeschini Journal of chemometrics 24 (3‐4), 194-201, 2010 | 423 | 2010 |
New molecular descriptors for 2D and 3D structures. Theory R Todeschini, M Lasagni, E Marengo Journal of chemometrics 8 (4), 263-272, 1994 | 392 | 1994 |
Structure/response correlations and similarity/diversity analysis by GETAWAY descriptors. 2. Application of the novel 3D molecular descriptors to QSAR/QSPR studies V Consonni, R Todeschini, M Pavan, P Gramatica Journal of chemical information and computer sciences 42 (3), 693-705, 2002 | 387 | 2002 |
CERAPP: collaborative estrogen receptor activity prediction project K Mansouri, A Abdelaziz, A Rybacka, A Roncaglioni, A Tropsha, A Varnek, ... Environmental health perspectives 124 (7), 1023-1033, 2016 | 336 | 2016 |
Multivariate comparison of classification performance measures D Ballabio, F Grisoni, R Todeschini Chemometrics and Intelligent Laboratory Systems 174, 33-44, 2018 | 320 | 2018 |
New local vertex invariants and molecular descriptors based on functions of the vertex degrees R Todeschini, V Consonni MATCH Commun. Math. Comput. Chem. 64 (2), 359-372, 2010 | 300 | 2010 |
Quantitative structure–activity relationship models for ready biodegradability of chemicals K Mansouri, T Ringsted, D Ballabio, R Todeschini, V Consonni Journal of chemical information and modeling 53 (4), 867-878, 2013 | 289 | 2013 |
Handbook of bibliometric indicators: Quantitative tools for studying and evaluating research R Todeschini, A Baccini Wiley-VCH, pp. 484, 2016 | 283 | 2016 |
Applicability domains for classification problems: benchmarking of distance to models for Ames mutagenicity set I Sushko, S Novotarskyi, R Körner, AK Pandey, A Cherkasov, J Li, ... Journal of chemical information and modeling 50 (12), 2094-2111, 2010 | 273 | 2010 |