PuSH - Publication Server of Helmholtz Zentrum München

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1.
Ezzati, M.* et al.: Worldwide trends in body-mass index, underweight, overweight, and obesity from 1975 to 2016: A pooled analysis of 2416 population-based measurement studies in 128.9 million children, adolescents, and adults. Lancet 390, 2627-2642 (2017)
2.
Novotarskyi, S. ; Sushko, I. ; Körner, R. ; Pandey, A.K. & Tetko, I.V.: A comparison of different QSAR approaches to modeling CYP450 1A2 inhibition. J. Chem. Inf. Model. 51, 1271-1280 (2011)
3.
Sushko, I. et al.: Online chemical modeling environment (OCHEM): Web platform for data storage, model development and publishing of chemical information. J. Comput.-Aided Mol. Des. 25, 533-554 (2011)
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Sushko, I. et al.: Applicability domain for in silico models to achieve accuracy of experimental measurements. J. Chemometr. 24, 202-208 (2010)
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Sushko, I. et al.: Applicability domains for classification problems: Benchmarking of distance to models for ames mutagenicity set. J. Chem. Inf. Model. 50, 2094-2111 (2010)
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Varnek, A.* et al.: Inductive transfer of knowledge: Application of multi-task learning and feature net approaches to model tissue-air partition coefficients. J. Chem. Inf. Model. 49, 133-144 (2009)
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Karthikeyan, M.* ; Krishnan, S.* ; Pandey, A.K. ; Bender, A.* & Tropsha, A.*: Distributed chemical computing using ChemStar: An open source java remote method invocation architecture applied to large scale molecular data from PubChem. J. Chem. Inf. Model. 48, 691-703 (2008)
8.
Tetko, I.V. et al.: 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, 1733-1746 (2008)