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ioana oprisiu
ioana oprisiu
Cheminformatics Data Scientist
Verified email at astrazeneca.com
Title
Cited by
Cited by
Year
QSPR approach to predict nonadditive properties of mixtures. Application to bubble point temperatures of binary mixtures of liquids
I Oprisiu, E Varlamova, E Muratov, A Artemenko, G Marcou, P Polishchuk, ...
Molecular Informatics 31 (6‐7), 491-502, 2012
702012
Modeling of non-additive mixture properties using the Online CHEmical database and Modeling environment (OCHEM)
I Oprisiu, S Novotarskyi, IV Tetko
Journal of cheminformatics 5, 1-7, 2013
502013
Findings of the second challenge to predict aqueous solubility
A Llinas, I Oprisiu, A Avdeef
Journal of chemical information and modeling 60 (10), 4791-4803, 2020
472020
Quantitative structure–property relationship (QSPR) modeling of normal boiling point temperature and composition of binary azeotropes
VP Solov’ev, I Oprisiu, G Marcou, A Varnek
Industrial & engineering chemistry research 50 (24), 14162-14167, 2011
352011
Prediction of in vivo pharmacokinetic parameters and time–exposure curves in rats using machine learning from the chemical structure
O Obrezanova, A Martinsson, T Whitehead, S Mahmoud, A Bender, ...
Molecular pharmaceutics 19 (5), 1488-1504, 2022
282022
In silico ADME in drug design–enhancing the impact
S Winiwarter, E Ahlberg, E Watson, I Oprisiu, M Mogemark, T Noeske, ...
ADMET and DMPK 6 (1), 15-33, 2018
142018
Publicly available models to predict normal boiling point of organic compounds
I Oprisiu, G Marcou, D Horvath, DB Brunel, F Rivollet, A Varnek
Thermochimica acta 553, 60-67, 2013
122013
In silico ADME modeling
I Oprisiu, S Winiwarter
Academic Press, 2021
82021
Modélisation QSPR de mélanges binaires non-additifs: application au comportement azéotropique
I Oprisiu
Université de Strasbourg, 2012
42012
Use of in silico models for compound property prediction to reduce the in vitro screening burden
E Ahlberg, C Bendtsen, L Carlsson, L Fredlund, B Jones, T Noeske, ...
Toxicology Letters 280, S285, 2017
12017
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