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Visvaldas Kairys

Visvaldas Kairys

Vilnius University - Vilnius / Lithuania
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 1872534
Vilniaus Universitetas
person_outline Visvaldas Kairys's MOST POPULAR ARTICLES
1-) The effective fragment potential method: A QM-based MM approach to modeling environmental effects in chemistry The Journal of Physical Chemistry A 105 (2), 293-307, 2001
2-) COD:: CIF:: Parser: an error-correcting CIF parser for the Perl language Applied Crystallography 49 (1), 292-301, 2016
3-) Binding affinity in drug design: experimental and computational techniques Expert opinion on drug discovery 14 (8), 755-768, 2019
4-) QM/MM boundaries across covalent bonds: a frozen localized molecular orbital-based approach for the effective fragment potential method The Journal of Physical Chemistry A 104 (28), 6656-6665, 2000
5-) HIV-1 protease inhibitors from inverse design in the substrate envelope exhibit subnanomolar binding to drug-resistant variants Journal of the American Chemical Society 130 (19), 6099-6113, 2008