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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 14, No 6 (2023) | Molecular dynamics simulation of the rearrangement of polyampholyte conformations on the surface of a charged oblate metal nanospheroid in a microwave electric field | Abstract PDF (Eng) similar documents |
| N. Yu. Kruchinin | ||
| "... Using molecular dynamics, the rearrangement of the conformational structure of polyampholytes ..." | ||
| Vol 14, No 2 (2023) | Study of ion partitioning in nanoporous materials by analytical approach and molecular modeling | Abstract PDF (Eng) similar documents |
| J. Dweik, M. Koabazb | ||
| "... such as Monte Carlo (GCMC) and classical molecular dynamics (MD). These techniques are used to study ..." | ||
| Vol 15, No 1 (2024) | Molecular dynamics study of nanofluids viscosity with carbon tubes | Abstract PDF (Eng) similar documents |
| V. Ya. Rudyak, S. L. Krasnolutskii, E. V. Lezhnev | ||
| "... The purpose of this paper is molecular dynamics simulation of viscosity of benzene-based ..." | ||
| 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 | ||
| "... In this paper, we consider relaxation processes in molecular systems containing single biomolecule ..." | ||
| 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 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 7, No 1 (2016): Special Issue: Proceedings of the 12th Biennial International Conference “Advanced Carbon Nanostructures” (ACNS’2015) | Comparative Raman study of photo-oligomer stability in the donor-acceptor fullerene complex {Pt(dbdtc)2}·C60 and pristine C60 | Abstract PDF (Eng) similar documents |
| K. P. Meletov, J. Arvanitidis, D. Christofilos, G. Kourouklis | ||
| "... temperature in the molecular donor-acceptor fullerene complex {Pt(dbdtc)2}·C60 (C60 complex with platinum ..." | ||
| Vol 8, No 4 (2017) | Calculations of the onset temperature for tunneling in multispin systems | Abstract PDF (Eng) similar documents |
| S. M. Vlasov, P. F. Bessarab, V. M. Uzdin, H. J´onsson | ||
| "... the over-the-barrier mechanism. An application to a monomer and a dimer of molecular magnets containing ..." | ||
| Vol 7, No 1 (2016): Special Issue: Proceedings of the 12th Biennial International Conference “Advanced Carbon Nanostructures” (ACNS’2015) | Pressure-assisted photopolymerization in the molecular donor-acceptor fullerene complex {Cd(dedtc)2}2C60 | Abstract PDF (Eng) similar documents |
| K. P. Meletov, J. Arvanitidis, D. Christofilos, G. Kourouklis | ||
| "... number of sp3-like coordinated carbon atoms per molecular cage. The polymer content increases ..." | ||
| Vol 12, No 1 (2021) | Domain wall evolution at nanowires in terms of 3D LLG equation initial-boundary problem | Abstract PDF (Eng) similar documents |
| S. Leble | ||
| "... that allows one to keep the domain wall dynamics, form and properties. For cylindrical-symmetric wire geometry ..." | ||
| Vol 12, No 3 (2021) | The F-index and coindex of V-Phenylenic Nanotubes and Nanotorus and their molecular complement graphs | Abstract PDF (Eng) similar documents |
| M. S.Y. Alsharafi, A. Q. Alameri | ||
| "... which often appear in drug molecular graphs. In this paper, we studied the F-index and F-coindex ..." | ||
| Vol 7, No 6 (2016) | Phonon transmission across an interface between two crystals | Abstract PDF (Eng) similar documents |
| A. P. Meilakhs | ||
| Vol 14, No 2 (2023) | Modeling the rarefied gas thermal conductivity in nanochannels | Abstract PDF (Eng) similar documents |
| V. Ya. Rudyak, E. V. Lezhnev | ||
| "... was calculated by the method of the stochastic molecular modelling. It was established that the thermal ..." | ||
| Vol 9, No 3 (2018) | Possibility of drug delivery due to hydrogen bonds formation in nanodiamonds and doxorubicin: molecular modeling | Abstract PDF (Eng) similar documents |
| A. N. Bokarev, I. L. Plastun | ||
| "... simulation. Using molecular modeling by the density functional theory method with the B3LYP functional ..." | ||
| Vol 11, No 3 (2020) | Stochastic molecular modeling the transport coefficients of rarefied gas and gas nanosuspensions | Abstract PDF (Eng) similar documents |
| V. Ya. Rudyak, E. V. Lezhnev | ||
| "... for rarefied gases and gas nanosuspensions. The proposed method is an alternative one to the molecular dynamics ..." | ||
| Vol 7, No 6 (2016) | Silicene is a phantom material | Abstract PDF (Eng) similar documents |
| E. F. Sheka | ||
| "... tetrels analogues from the viewpoint of the spin molecular theory taking into account the electron ..." | ||
| Vol 11, No 2 (2020) | Particle transport in a network of quantum harmonic oscillators | Abstract PDF (Eng) similar documents |
| J. R. Yusupov, Kh. Sh. Matyokubov, K. K. Sabirov | ||
| "... In this paper, we address the problem of a particle dynamics in a network of quantum harmonic ..." | ||
| Vol 11, No 2 (2020) | Dynamics of polarons in branched conducting polymers | Abstract PDF (Eng) similar documents |
| K. K. Sabirov, J. R. Yusupov, Kh. Sh. Matyokubov | ||
| "... dynamics in such a polymers, we use the modified SSH-model in combination with quantum graph concept ..." | ||
| Vol 8, No 1 (2017) | Tunable wave packet transport in branched periodic lattices with time-dependent external field | Abstract PDF (Eng) similar documents |
| J. Yusupov | ||
| "... We study the dynamics of a Gaussian wave packet in a branched system of periodic lattices driven ..." | ||
| Vol 8, No 1 (2017) | Accelerated dynamics in adiabatically-tunable asymmetric double-well potential | Abstract PDF (Eng) similar documents |
| I. Setiawan, B. E. Gunara, J. S. Kosasih, K. Nakamura | ||
| "... We study a scheme for the acceleration of adiabatic quantum dynamics. Masuda-Nakamura’s theory ..." | ||
| Vol 8, No 1 (2017) | Fast-forward of standard dynamics with use of electromagnetic field | Abstract PDF (Eng) similar documents |
| G. Babajanova, K. Nakamura | ||
| "... dynamics for a charged particle. The idea allows the acceleration of both amplitude and phase of the wave ..." | ||
| Vol 10, No 5 (2019) | Transparent vertex boundary conditions for quantum graphs: Simplified approach | Abstract PDF (Eng) similar documents |
| M. M. Aripov, K. K. Sabirov, J. R. Yusupov | ||
| Vol 14, No 2 (2023) | Corrugated non-stationary optical fiber | Abstract PDF (Eng) similar documents |
| T. Akhmadjanov, E. Yu. Rakhimov | ||
| 1 - 25 of 25 Items | ||
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