Mechanistic insights into the CAM-induced disruption of the HBV capsid revealed by all-atom molecular dynamics simulations

被引:0
|
作者
Segura, Carolina Perez [1 ]
Chong, Boon [2 ]
Hadden-Perilla, Jodi A. [1 ]
机构
[1] Univ Delaware, Dept Chem & Biochem, Newark, DE USA
[2] Singapore Massachusetts Inst Technol Alliance Res, Antimicrobial Resistance Interdisciplinary Res, Singapore, Singapore
关键词
D O I
暂无
中图分类号
Q6 [生物物理学];
学科分类号
071011 ;
摘要
1779-Plat
引用
收藏
页码:322A / 322A
页数:1
相关论文
共 50 条
  • [41] Benchmarking Molecular Dynamics Force Fields for All-Atom Simulations of Biological Condensates
    Sarthak, Kumar
    Winogradoff, David
    Ge, Yingda
    Myong, Sua
    Aksimentiev, Aleksei
    JOURNAL OF CHEMICAL THEORY AND COMPUTATION, 2023, 19 (12) : 3721 - 3740
  • [42] Effects of Galactosylation in Immunoglobulin G from All-Atom Molecular Dynamics Simulations
    Fortunato, Michael E.
    Colina, Coray M.
    JOURNAL OF PHYSICAL CHEMISTRY B, 2014, 118 (33): : 9844 - 9851
  • [43] All-Atom Molecular Dynamics Simulations on a Single Chain of PET and PEV Polymers
    Sangkhawasi, Mattanun
    Remsungnen, Tawun
    Vangnai, Alisa S.
    Poo-arporn, Rungtiva P.
    Rungrotmongkol, Thanyada
    POLYMERS, 2022, 14 (06)
  • [44] Timescales for convergence in all-atom molecular dynamics simulations of hydrated amorphous xylan
    Ramamohan, Poornima
    Furo, Istvan
    Wohlert, Jakob
    CARBOHYDRATE POLYMERS, 2022, 286
  • [45] Protein Diffusion in a Dense Solution Studied by All-Atom Molecular Dynamics Simulations
    Nawrocki, Grzegorz
    Wang, Po-hung
    Yu, Isseki
    Sugita, Yuji
    Feig, Michael
    BIOPHYSICAL JOURNAL, 2018, 114 (03) : 233A - 234A
  • [46] Monte Carlo vs molecular dynamics for all-atom polypeptide folding simulations
    Ulmschneider, Jakob P.
    Ulmschneider, Martin B.
    Di Nola, Alfredo
    JOURNAL OF PHYSICAL CHEMISTRY B, 2006, 110 (33): : 16733 - 16742
  • [47] The Assembly Switch Mechanism of FtsZ Filament Revealed by All-Atom Molecular Dynamics Simulations and Coarse-Grained Models
    Lv, Dashuai
    Li, Jingyuan
    Ye, Sheng
    FRONTIERS IN MICROBIOLOGY, 2021, 12
  • [48] Solvent-induced membrane stress in biofuel production: molecular insights from small-angle scattering and all-atom molecular dynamics simulations
    Smith, Micholas Dean
    Pingali, Sai Venkatesh
    Elkins, James G.
    Bolmatov, Dima
    Standaert, Robert F.
    Nickels, Jonathan D.
    Urban, Volker S.
    Katsaras, John
    Davison, Brian H.
    Smith, Jeremy C.
    Petridis, Loukas
    GREEN CHEMISTRY, 2020, 22 (23) : 8278 - 8288
  • [49] Evolutionary conservation of protein dynamics: insights from all-atom molecular dynamics simulations of 'peptidase' domain of Spt16
    Gaur, Neeraj K.
    Ghosh, Biplab
    Goyal, Venuka Durani
    Kulkarni, Kiran
    Makde, Ravindra D.
    JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2023, 41 (04): : 1445 - 1457
  • [50] Structures of single, double and triple layers of lipids adsorbed on graphene: Insights from all-atom molecular dynamics simulations
    Rivel, Timothee
    Yesylevskyy, Semen O.
    Ramseyer, Christophe
    CARBON, 2017, 118 : 358 - 369