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Issue | Title | |
Vol 16, No 2 (2025) | Alcohol dehydrogenase: molecular dynamics study of conformational and orientational behaviour of the enzyme in complex with nad during sorption on the surface of electrode materials using graphite as an example | Abstract PDF (Eng) similar documents |
I. A. Baigunov, Kh. T. Kholmurodov, P. P. Gladyshev | ||
"... In this work, computer molecular dynamics (MD) studies of the orientation and structural ..." | ||
Vol 12, No 5 (2021) | Modeling the evolution of surface nanobubbles | Abstract PDF (Eng) similar documents |
I. A. Nesterenko, I. Y. Popov | ||
Vol 2, No 3 (2011) | The features of structure transformation caused by nano-burnishing process | Abstract PDF (Eng) similar documents |
A. I. Dmitriev, A. Yu. Nikonov, V. P. Kuznetsov | ||
"... In the paper the method of molecular dynamics is used to investigate the features of structure ..." | ||
Vol 2, No 2 (2011) | Molecular-dynamic investigation of contact interaction of pure metals | Abstract PDF (Eng) similar documents |
A. Yu. Nikonov, A. I. Dmitriev, S. G. Psakhie | ||
"... In using the method of molecular dynamics simulation of contact interaction between the copper ..." | ||
Vol 2, No 2 (2011) | Simulation of structural transformations in copper nanoparticles under collision | Abstract PDF (Eng) similar documents |
A. Yu. Smolin, N. V. Roman, K. P. Zolnikov, S. G. Psakhie, V. K. Kedrinskii | ||
"... performed by molecular dynamics method. The inter-atomic interaction was described within the embedded atom ..." | ||
Vol 4, No 5 (2013) | Accurate energy conservation in molecular dynamics simulation | Abstract PDF (Eng) similar documents |
O. A. Zolotov, V. E. Zalizniak | ||
"... In molecular dynamics, Hamiltonian systems of differential equations are numerically integrated ..." | ||
Vol 12, No 5 (2021) | Energy relaxation in molecular systems containing salt ions | Abstract PDF (Eng) similar documents |
M. A. Baranov, E. N. Velichko, E. K. Nepomnyashchaya, I. V. Pleshakov | ||
Vol 9, No 3 (2018) | Molecular dynamics simulation of fluid viscosity in nanochannels | Abstract PDF (Eng) similar documents |
V. Rudyak, A. Belkin | ||
"... The viscosity of fluids in a plane nanochannel has been studied by molecular dynamics method ..." | ||
Vol 13, No 3 (2022) | Assessment of structural changes in proteins and surrounding water molecules in solution according to SAXS and MD data | Abstract PDF (Eng) similar documents |
A. V. Smirnov, A. M. Semenov, Yu. B. Porozov, B. A. Fedorov | ||
"... The SASPAR program for calculation of SAXS of proteins in solution uses trajectories of molecular ..." | ||
Vol 2, No 4 (2011) | Simulation of flows in nanochannels by the molecular dynamics method | Abstract similar documents |
V. Ya. Rudyak, A. A. Belkin, V. V. Egorov, D. A. Ivanov | ||
"... On the basis of molecular dynamics method the algorithm for the first time enables to simulate ..." | ||
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