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Page 1
Competing Routes in the Extraction of Lanthanide Nitrates by 1,10-Phenanthroline-2,9-diamides: An Impact of Structure of Complexes on the Extraction.
Int J Mol Sci. 2022 Dec 8;23(24):15538. doi: 10.3390/ijms232415538.
Int J Mol Sci. 2022.
PMID: 36555179
Free PMC article.
Continuous molecular fields and the concept of molecular co-fields in structure-activity studies.
Baskin II, Zhokhova NI.
Baskin II, et al. Among authors: zhokhova ni.
Future Med Chem. 2019 Oct;11(20):2701-2713. doi: 10.4155/fmc-2018-0360. Epub 2019 Oct 9.
Future Med Chem. 2019.
PMID: 31596146
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Continuous indicator fields: a novel universal type of molecular fields.
Sitnikov GV, Zhokhova NI, Ustynyuk YA, Varnek A, Baskin II.
Sitnikov GV, et al. Among authors: zhokhova ni.
J Comput Aided Mol Des. 2015 Mar;29(3):233-47. doi: 10.1007/s10822-014-9818-z. Epub 2014 Dec 2.
J Comput Aided Mol Des. 2015.
PMID: 25449975
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Energy-based Neural Networks as a Tool for Harmony-based Virtual Screening.
Zhokhova NI, Baskin II.
Zhokhova NI, et al.
Mol Inform. 2017 Nov;36(11). doi: 10.1002/minf.201700054. Epub 2017 Jun 19.
Mol Inform. 2017.
PMID: 28627811
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Predictive Models for HOMO and LUMO Energies of N-Donor Heterocycles as Ligands for Lanthanides Separation.
Solov'ev VP, Ustynyuk YA, Zhokhova NI, Karpov KV.
Solov'ev VP, et al. Among authors: zhokhova ni.
Mol Inform. 2018 Nov;37(11):e1800025. doi: 10.1002/minf.201800025. Epub 2018 Jul 4.
Mol Inform. 2018.
PMID: 29971949
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The continuous molecular fields approach to building 3D-QSAR models.
Baskin II, Zhokhova NI.
Baskin II, et al. Among authors: zhokhova ni.
J Comput Aided Mol Des. 2013 May;27(5):427-42. doi: 10.1007/s10822-013-9656-4. Epub 2013 May 30.
J Comput Aided Mol Des. 2013.
PMID: 23719959
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