SAR and QSAR modeling of a large collection of LD50 rat acute oral toxicity data D Gadaleta, K Vuković, C Toma, GJ Lavado, AL Karmaus, K Mansouri, ... Journal of Cheminformatics 11, 1-16, 2019 | 149 | 2019 |
CATMoS: collaborative acute toxicity modeling suite K Mansouri, AL Karmaus, J Fitzpatrick, G Patlewicz, P Pradeep, D Alberga, ... Environmental health perspectives 129 (4), 047013, 2021 | 117 | 2021 |
Investigating combined toxicity of binary mixtures in bees: Meta-analysis of laboratory tests, modelling, mechanistic basis and implications for risk assessment E Carnesecchi, C Svendsen, S Lasagni, A Grech, N Quignot, B Amzal, ... Environment International 133, 105256, 2019 | 84 | 2019 |
A new semi-automated workflow for chemical data retrieval and quality checking for modeling applications D Gadaleta, A Lombardo, C Toma, E Benfenati Journal of cheminformatics 10, 1-13, 2018 | 79 | 2018 |
QSAR modeling of ToxCast assays relevant to the molecular initiating events of AOPs leading to hepatic steatosis D Gadaleta, S Manganelli, A Roncaglioni, C Toma, E Benfenati, ... Journal of chemical information and modeling 58 (8), 1501-1517, 2018 | 77 | 2018 |
Development of a neurotoxicity assay that is tuned to detect mitochondrial toxicants J Delp, M Funke, F Rudolf, A Cediel, SH Bennekou, W van der Stel, ... Archives of Toxicology 93, 1585-1608, 2019 | 55 | 2019 |
Ecotoxicological QSAR modeling of organic compounds against fish: Application of fragment based descriptors in feature analysis K Khan, D Baderna, C Cappelli, C Toma, A Lombardo, K Roy, E Benfenati Aquatic Toxicology 212, 162-174, 2019 | 52 | 2019 |
Integrating QSAR models predicting acute contact toxicity and mode of action profiling in honey bees (A. mellifera): Data curation using open source databases, performance … E Carnesecchi, C Toma, A Roncaglioni, N Kramer, E Benfenati, ... Science of the Total Environment 735, 139243, 2020 | 41 | 2020 |
QSAR models for biocides: The example of the prediction of Daphnia magna acute toxicity M Marzo, GJ Lavado, F Como, AP Toropova, AA Toropov, D Baderna, ... SAR and QSAR in Environmental Research 31 (3), 227-243, 2020 | 38 | 2020 |
New models to predict the acute and chronic toxicities of representative species of the main trophic levels of aquatic environments C Toma, CI Cappelli, A Manganaro, A Lombardo, J Arning, E Benfenati Molecules 26 (22), 6983, 2021 | 24 | 2021 |
Zebrafish AC50 modelling:(Q) SAR models to predict developmental toxicity in zebrafish embryo GJ Lavado, D Gadaleta, C Toma, A Golbamaki, AA Toropov, AP Toropova, ... Ecotoxicology and Environmental Safety 202, 110936, 2020 | 22 | 2020 |
QSAR development for plasma protein binding: influence of the ionization state C Toma, D Gadaleta, A Roncaglioni, A Toropov, A Toropova, M Marzo, ... Pharmaceutical Research 36, 1-9, 2019 | 21 | 2019 |
QSAR models for human carcinogenicity: an assessment based on oral and inhalation slope factors C Toma, A Manganaro, G Raitano, M Marzo, D Gadaleta, D Baderna, ... Molecules 26 (1), 127, 2020 | 19 | 2020 |
SpheraCosmolife: A new tool for the risk assessment of cosmetic products G Selvestrel, F Robino, D Baderna, S Manganelli, D Asturiol, ... ALTEX-Alternatives to animal experimentation 38 (4), 565-579, 2021 | 18 | 2021 |
Towards an understanding of the mode of action of human aromatase activity for azoles through quantum chemical descriptors-based regression and structure activity relationship … C Chayawan, C Toma, E Benfenati, AY Caballero Alfonso Molecules 25 (3), 739, 2020 | 9 | 2020 |
Skin sensitization quantitative QSAR models based on mechanistic structural alerts G Selvestrel, D Baderna, C Toma, AYC Alfonso, A Gamba, E Benfenati Toxicology 468, 153111, 2022 | 6 | 2022 |
Prediction of the partition coefficient between adipose tissue and blood for environmental chemicals: from single QSAR models to an integrated approach CI Cappelli, S Manganelli, C Toma, E Benfenati, E Mombelli Molecular Informatics 40 (3), 2000072, 2021 | 4 | 2021 |
SAR and QSAR modeling of a large collection of LD50 rat acute oral toxicity data. J Cheminform 11 (1): 58 D Gadaleta, K Vuković, C Toma | 4 | 2019 |
Correction to: A new semi-automated workflow for chemical data retrieval and quality checking for modeling applications D Gadaleta, A Lombardo, C Toma, E Benfenati Journal of Cheminformatics 11, 31, 2019 | 2 | 2019 |
Impact of REACH legislation on the production and importation of CMR (carcinogen, mutagen and reproductive) and explosive chemicals in Italy from 2011 to 2015 M Marzo, C Leone, C Toma, A Roncaglioni, S Gianazzi, R Knauf, ... Regulatory Toxicology and Pharmacology 101, 166-171, 2019 | 2 | 2019 |