المؤلفون: Radost Herboth, Alexander P. Lyubartsev

المصدر: ACS Omega, Vol 9, Iss 34, Pp 36718-36731 (2024)

مصطلحات موضوعية: Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2470-1343

URL الوصول: https://doaj.org/article/ef0d4acd876a46afb0857b077627ba51

المؤلفون: Fredrik Grote, Marzieh Saeedimasine, Alexander P. Lyubartsev

المصدر: AIP Advances, Vol 14, Iss 11, Pp 115123-115123-14 (2024)

مصطلحات موضوعية: Physics, QC1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2158-3226

URL الوصول: https://doaj.org/article/97dede34e40c4455b8ba6af26f3edfe0

المؤلفون: Roja Rahmani, Alexander P. Lyubartsev

المصدر: Nanomaterials, Vol 13, Iss 15, p 2239 (2023)

مصطلحات موضوعية: zinc sulfide, surface properties, biomolecular adsorption, molecular dynamics, Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://www.mdpi.com/2079-4991/13/15/2239; https://doaj.org/toc/2079-4991

URL الوصول: https://doaj.org/article/58b4852a642d4b95b0ad86a372a154f4

المؤلفون: Tiedong Sun, Vishal Minhas, Nikolay Korolev, Alexander Mirzoev, Alexander P. Lyubartsev, Lars Nordenskiöld

المصدر: Frontiers in Molecular Biosciences, Vol 8 (2021)

مصطلحات موضوعية: DNA condensation, coarse-grained model, molecular renormalization group, inverse Monte Carlo, multi-scale coarse-graining, force matching, Biology (General), QH301-705.5

وصف الملف: electronic resource

Relation: https://www.frontiersin.org/articles/10.3389/fmolb.2021.645527/full; https://doaj.org/toc/2296-889X

URL الوصول: https://doaj.org/article/836203233b1c4b439c37f67214f14421

المؤلفون: Paulo H. B. Brant Carvalho, Amber Mace, Inna Martha Nangoi, Alexandre A. Leitão, Chris A. Tulk, Jamie J. Molaison, Ove Andersson, Alexander P. Lyubartsev, Ulrich Häussermann

المصدر: Crystals, Vol 12, Iss 1, p 9 (2021)

مصطلحات موضوعية: hydrogen hydrate, neon hydrate, pressure effects, neutron diffraction, molecular dynamics, clathrate hydrates, Crystallography, QD901-999

وصف الملف: electronic resource

Relation: https://www.mdpi.com/2073-4352/12/1/9; https://doaj.org/toc/2073-4352

URL الوصول: https://doaj.org/article/5d07f04a826c4a8988ce2a10171c8112

المؤلفون: Matúš Rebič, Francesca Mocci, Jozef Uličný, Alexander P. Lyubartsev, Aatto Laaksonen

المصدر: ACS Omega, Vol 2, Iss 2, Pp 386-396 (2017)

مصطلحات موضوعية: Chemistry, QD1-999

وصف الملف: electronic resource

Relation: https://doaj.org/toc/2470-1343

URL الوصول: https://doaj.org/article/227eef7f4b354b6dbf45388ff072b82e

المؤلفون: Tiedong Sun, Vishal Minhas, Alexander Mirzoev, Nilolay Korolev, Alexander P. Lyubartsev, Lars Nordenskiöld

Relation: https://zenodo.org/communities/biophysicalmodels; https://doi.org/10.5281/zenodo.5833005; https://doi.org/10.5281/zenodo.5833006; oai:zenodo.org:5833006

الاتاحة: https://doi.org/10.5281/zenodo.5833006

المؤلفون: Mikhail Ivanov (3447290), Alexander P. Lyubartsev (281521)

مصطلحات موضوعية: Biophysics, Biotechnology, Cancer, Computational Biology, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Physical Sciences not elsewhere classified, POPE, glycero -3-phosphocholine, DMPC, titanium dioxide surfaces, anatase surfaces, 1- palmitoyl -2-oleoyl sn, titanium dioxide, lipid headgroup atoms, lipid bilayers, ethanolamine group, number density profiles, titanium dioxide surface curvature, binding modes, Atomistic Molecular Dynamics Simula., adsorption strength, glycero -3-phosphoethanolamine, dynamics study, TiO 2 Nanosurfaces, cell membranes, hydrogen bonds, lipid concentration

Relation: https://figshare.com/articles/journal_contribution/Atomistic_Molecular_Dynamics_Simulations_of_Lipids_Near_TiO_sub_2_sub_Nanosurfaces/14994618

الاتاحة: https://doi.org/10.1021/acs.jpcb.1c04547.s001

المؤلفون: Paulo H. B. Brant Carvalho, Mikhail Ivanov, Ove Andersson, Thomas Loerting, Marion Bauer, Chris A. Tulk, Bianca Haberl, Luke L. Daemen, Jamie J. Molaison, Katrin Amann-Winkel, Alexander P. Lyubartsev, Craig L. Bull, Nicholas P. Funnell, Ulrich Häussermann

المصدر: Physical Chemistry Chemical Physics

مصطلحات موضوعية: General Physics and Astronomy, Physical and Theoretical Chemistry, Condensed Matter Physics, Den kondenserade materiens fysik

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d06094b25c5357ac888f0ab2838cc8b9
https://doi.org/10.1039/d3cp00539a

المؤلفون: Saeed Mortezazadeh, Yousef Jamali, Hossein Naderi-Manesh, Alexander P Lyubartsev

المصدر: PLoS ONE, Vol 14, Iss 4, p e0214673 (2019)

مصطلحات موضوعية: Medicine, Science

Relation: https://doi.org/10.1371/journal.pone.0214673; https://doaj.org/toc/1932-6203; https://doaj.org/article/c86681803e64493ea352a7363121c481

الاتاحة: https://doi.org/10.1371/journal.pone.0214673
https://doaj.org/article/c86681803e64493ea352a7363121c481

المؤلفون: Fredrik Grote, Alexander P. Lyubartsev

المصدر: Nanoscale. 14:16536-16547

مصطلحات موضوعية: General Materials Science

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::d7139ca74f3625a797287cb0e1979cea
https://doi.org/10.1039/d2nr02354g

المؤلفون: Fredrik Grote, Alexander P Lyubartsev, Sergey V Dvinskikh, Vihbu Rinwa, Jan Holmback

المصدر: Physical Chemistry Chemical Physics.

مصطلحات موضوعية: General Physics and Astronomy, Physical and Theoretical Chemistry

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::65d21178113fbb8b202e4e073fe12b74
https://doi.org/10.1039/d3cp00425b

المؤلفون: Alexander P. Lyubartsev, Erik G. Brandt, Marzieh Saeedimasine

المصدر: The Journal of Physical Chemistry. B
The Journal of Physical Chemistry B

مصطلحات موضوعية: Materials science, 010304 chemical physics, chemistry.chemical_element, Nanotechnology, 010402 general chemistry, 01 natural sciences, Article, 0104 chemical sciences, Surfaces, Coatings and Films, Nanomaterials, Adsorption, chemistry, 13. Climate action, 0103 physical sciences, Materials Chemistry, Physical and Theoretical Chemistry, Carbon, Carbon nanomaterials

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e3ce238c72992a80168544da751d083e
http://europepmc.org/articles/PMC7871326

المؤلفون: Fredrik Grote, Alexander P. Lyubartsev

المصدر: The Journal of Physical Chemistry. B

مصطلحات موضوعية: Physics, Physics::Biological Physics, 010304 chemical physics, Lipid Bilayers, Molecular Conformation, Molecular Dynamics Simulation, 010402 general chemistry, 01 natural sciences, Molecular mechanics, Article, Force field (chemistry), 0104 chemical sciences, Surfaces, Coatings and Films, Condensed Matter::Soft Condensed Matter, Classical mechanics, 0103 physical sciences, Phosphatidylcholines, Materials Chemistry, Physical and Theoretical Chemistry, Phospholipids

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c66ee8e6d9c182e08330d6c29c56f699
https://doi.org/10.1021/acs.jpcb.0c06386

المؤلفون: Paulo H. B. Brant Carvalho, Amber Mace, Inna Martha Nangoi, Alexandre A. Leitão, Chris A. Tulk, Jamie J. Molaison, Ove Andersson, Alexander P. Lyubartsev, Ulrich Häussermann

المصدر: Crystals, Vol 12, Iss 9, p 9 (2022)

مصطلحات موضوعية: Crystallography, neon hydrate, neutron diffraction, QD901-999, pressure effects, Materials Chemistry, Materialkemi, Condensed Matter Physics, clathrate hydrates, Den kondenserade materiens fysik, molecular dynamics, hydrogen hydrate

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=dedup_wf_001::d63ce958d4eca644b4c3eec1b33d493a
http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-467404

المؤلفون: Vishal Minhas, Alexander Mirzoev, Tiedong Sun, Lars Nordenskiöld, Nikolay Korolev, Alexander P. Lyubartsev

المساهمون: School of Biological Sciences

المصدر: The Journal of Physical Chemistry B. 124:38-49

مصطلحات موضوعية: Flexibility (engineering), Base Sequence, 010304 chemical physics, Computer science, Work (physics), Control engineering, DNA, A-Form, DNA, Molecular Dynamics Simulation, Sodium Chloride, 010402 general chemistry, 01 natural sciences, Amber, 0104 chemical sciences, Surfaces, Coatings and Films, 0103 physical sciences, Materials Chemistry, Nucleic Acid Conformation, Mathematics::Applied mathematics::Simulation and modeling+ [Science], Physical and Theoretical Chemistry, DNA, B-Form, Parametrization

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::05c2ba8067f69c96e199c840b76bb9fb
https://doi.org/10.1021/acs.jpcb.9b09106

المؤلفون: Paulo H B, Brant Carvalho, Pedro Ivo R, Moraes, Alexandre A, Leitão, Ove, Andersson, Chris A, Tulk, Jamie, Molaison, Alexander P, Lyubartsev, Ulrich, Häussermann

المصدر: RSC advances. 11(49)

URL الوصول: https://explore.openaire.eu/search/publication?articleId=pmid________::6a0680f2675c0858d2cd07a43713a8f3
https://pubmed.ncbi.nlm.nih.gov/35479871

المؤلفون: Erik G. Brandt, Vladimir Lobaskin, Alexander P. Lyubartsev, Ian Rouse, M. Schneemilch, Nick Quirke, Konstantinos Kotsis, David A. Power

المصدر: Physical Chemistry Chemical Physics

مصطلحات موضوعية: chemistry.chemical_classification, Titanium, Anatase, Materials science, Surface Properties, Biomolecule, General Physics and Astronomy, Proteins, Water, Nanotechnology, Active surface, Molecular Dynamics Simulation, Characterization (materials science), Nanomaterials, Molecular dynamics, chemistry, Nano, Nanoparticles, Density functional theory, Physical and Theoretical Chemistry, Density Functional Theory

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0147845c45e6b21794bfbdd7de0249f7
https://pubmed.ncbi.nlm.nih.gov/34109956

المؤلفون: Nikolay Korolev, Di Luo, Alexander P. Lyubartsev, Lars Nordenskiöld

المصدر: Polymers, Vol 6, Iss 6, Pp 1655-1675 (2014)

مصطلحات موضوعية: DNA, coarse-grained model, molecular dynamics, persistence length, Organic chemistry, QD241-441

Relation: http://www.mdpi.com/2073-4360/6/6/1655; https://doaj.org/toc/2073-4360; https://doaj.org/article/cd081128d669483a9e6bf879c60bf9c9

الاتاحة: https://doi.org/10.3390/polym6061655
https://doaj.org/article/cd081128d669483a9e6bf879c60bf9c9

المؤلفون: A. M. Nikitin, Alexander P. Lyubartsev, Vladislava Milchevskaya

المصدر: Journal of computational chemistryREFERENCES. 42(11)

مصطلحات موضوعية: Physics, 010304 chemical physics, Computation, Monte Carlo method, Solvation, General Chemistry, 010402 general chemistry, 01 natural sciences, 0104 chemical sciences, Computational Mathematics, Molecular dynamics, 0103 physical sciences, A priori and a posteriori, Free energies, Statistical physics, Energy (signal processing)

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e46f94825914fd02f589a7ddcfece855
https://pubmed.ncbi.nlm.nih.gov/33618426