화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Catalytic Reaction Mechanism in Native and Mutant Catechol-O-methyltransferase from the Adaptive String Method and Mean Reaction Force Analysis
Saez DA, Zinovjev K, Tunon I, Voringer-Martinez E
Journal of Physical Chemistry B, 122(38), 8861, 2018
2 Adaptive Finite Temperature String Method in Collective Variables
Zinovjev K, Tunon I
Journal of Physical Chemistry A, 121(51), 9764, 2017
3 Thermal Isomerization Mechanism in Dronpa and Its Mutants
Smyrnova D, Zinovjev K, Tunon I, Ceulemans A
Journal of Physical Chemistry B, 120(50), 12820, 2016
4 Dehydrochlorination of Hexachlorocyclohexanes Catalyzed by the LinA Dehydrohalogenase. A QM/MM Study
Manna RN, Zinovjev K, Tunon I, Dybala-Defratyka A
Journal of Physical Chemistry B, 119(49), 15100, 2015
5 Dynamics and Reactivity in Thermus aquaticus N6-Adenine Methyltransferase
Aranda J, Zinovjev K, Roca M, Tunon I
Journal of the American Chemical Society, 136(46), 16227, 2014