Alexey Aleksandrov

Publication Activity (10 Years)

Years Active: 2006-2022
Publications (10 Years): 4

Top Topics

Information Theory

Active Contours

Gradient Vector Flow

Top Venues

J. Comput. Chem.

J. Chem. Inf. Model.

Publications

Anastasia Croitoru, Alexey Aleksandrov
Parametrization of Force Field Bonded Terms under Structural Inconsistency. J. Chem. Inf. Model. 62 (19) (2022)
Alexey Aleksandrov
A Molecular Mechanics Model for Flavins. J. Comput. Chem. 40 (32) (2019)
Alexey Aleksandrov, Fang-Yu Lin, Benoît Roux, Alexander D. MacKerell Jr.
Combining the polarizable Drude force field with a continuum electrostatic Poisson-Boltzmann implicit solvation model. J. Comput. Chem. 39 (22) (2018)
You Xu, Kenno Vanommeslaeghe, Alexey Aleksandrov, Alexander D. MacKerell Jr., Lennart Nilsson
Additive CHARMM force field for naturally occurring modified ribonucleotides. J. Comput. Chem. 37 (10) (2016)
Nikolay V. Kotov, Declan G. Bates, Antonina N. Gizatullina, Bulat Gilaziev, Rustem N. Khairullin, Michael Z. Q. Chen, Ignat Drozdov, Yoshinori Umezawa, Christian Hundhausen, Alexey Aleksandrov, Xing-Gang Yan, Sarah K. Spurgeon, C. Mark Smales, Najl V. Valeyev
Computational modelling elucidates the mechanism of ciliary regulation in health and disease. BMC Syst. Biol. 5 (2011)
Alexey Aleksandrov, Thomas Simonson
A molecular mechanics model for imatinib and imatinib: kinase binding. J. Comput. Chem. 31 (7) (2010)
Alexey Aleksandrov, Thomas Simonson
Molecular mechanics models for tetracycline analogs. J. Comput. Chem. 30 (2) (2009)
Alexey Aleksandrov, Thomas Simonson
The tetracycline: Mg2+ complex: A molecular mechanics force field. J. Comput. Chem. 27 (13) (2006)