I. V. Svitanko

发表

Quantifying Possible Routes for SpnF-Catalyzed Formal Diels-Alder Cycloaddition.

M. G. Medvedev, I. S. Bushmarinov, F. Novikov, 2017, Journal of the American Chemical Society.

Modeling of novel CDK7 inhibitors activity by molecular dynamics and free energy perturbation methods

F. Novikov, V. Stroylov, I. Titov, 2020 .

Charge redistribution in the SpnF-catalyzed Diels–Alder reaction

K. Lyssenko, I. S. Bushmarinov, F. Novikov, 2017 .

Exhaustive conformational search for transition states: the case of catechol O-methyltransferase active site

Alexey A. Zeifman, I. S. Bushmarinov, F. Novikov, 2017 .

Computational identification of disulfiram and neratinib as putative SARS-CoV-2 main protease inhibitors

V. Stroylov, I. V. Svitanko, I. Svitanko, 2020, Mendeleev Communications.

The first synthesis and molecular docking studies of diastereomerically pure substituted 4-amino-7-hydroxyheptanoic acids

A. Sukhorukov, S. Ioffe, G. Chilov, 2011 .

An explicit account of solvation is essential for modeling Suzuki-Miyaura coupling in protic solvents.

Alexey A. Zeifman, F. Novikov, V. Stroylov, 2015, Dalton transactions.

Rational design and synthesis of new PARP1 inhibitors

S. Khodyreva, O. Lavrik, A. Zakharenko, 2012 .

N,O-acylotropy in N-methylpentanehydroxamic acid

O. S. Chizhov, I. V. Svitanko, Emmanuil I. Troyansky, 1984 .

Target synthesis of bioactive thioglycolurils, based on QSAR predictions

G. A. Gazieva, A. Kravchenko, L. Anikina, 2013 .

Computational modeling and target synthesis of monomethoxy-substituted o-diphenylisoxazoles with unexpectedly high antimitotic microtubule destabilizing activity.

V. Semenov, M. Semenova, V. Stroylov, 2020, Bioorganic & medicinal chemistry letters.

Molecular basis of COVID-19 pathogenesis

F. Novikov, I. V. Svitanko, V. Nebolsin, 2020, Russian Chemical Reviews.

Diphenylacetylene hydrogenation on a PdAg /Al2O3 single-atom catalyst: an experimental and DFT study

A. Stakheev, D. S. Krivoruchenko, I. S. Mashkovsky, 2017 .