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2020 – today
- 2021
[j6]Nicola Chirico
, Alessandro Sangion, Paola Gramatica, Linda Bertato, Ilaria Casartelli, Ester Papa:
QSARINS-Chem standalone version: A new platform-independent software to profile chemicals for physico-chemical properties, fate, and toxicity. J. Comput. Chem. 42(20): 1452-1460 (2021)
2010 – 2019
- 2013
- [j5]Paola Gramatica, Nicola Chirico, Ester Papa, Stefano Cassani, Simona Kovarich:
QSARINS: A new software for the development, analysis, and validation of QSAR MLR models. J. Comput. Chem. 34(24): 2121-2132 (2013)
2000 – 2009
- 2008
- [j4]Hao Zhu, Alexander Tropsha, Denis Fourches, Alexandre Varnek, Ester Papa, Paola Gramatica, Tomas Öberg, Phuong Dao, Artem Cherkasov, Igor V. Tetko:
Combinatorial QSAR Modeling of Chemical Toxicants Tested against Tetrahymena pyriformis. J. Chem. Inf. Model. 48(4): 766-784 (2008) - [j3]Igor V. Tetko, Iurii Sushko, Anil Kumar Pandey, Hao Zhu, Alexander Tropsha, Ester Papa, Tomas Öberg, Roberto Todeschini, Denis Fourches, Alexandre Varnek:
Critical Assessment of QSAR Models of Environmental Toxicity against Tetrahymena pyriformis: Focusing on Applicability Domain and Overfitting by Variable Selection. J. Chem. Inf. Model. 48(9): 1733-1746 (2008) - 2005
- [j2]Ester Papa, Fulvio Villa, Paola Gramatica:
Statistically Validated QSARs, Based on Theoretical Descriptors, for Modeling Aquatic Toxicity of Organic Chemicals in Pimephales promelas (Fathead Minnow). J. Chem. Inf. Model. 45(5): 1256-1266 (2005) - 2004
- [j1]Paola Gramatica, Pamela Pilutti, Ester Papa:
Validated QSAR Prediction of OH Tropospheric Degradation of VOCs: Splitting into Training-Test Sets and Consensus Modeling. J. Chem. Inf. Model. 44(5): 1794-1802 (2004)
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