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在膜涨落存在的情况下,模型病毒衣壳的自组装动力学。

Dynamics of self-assembly of model viral capsids in the presence of a fluctuating membrane.

机构信息

Faculty of Physics, University of Vienna, Boltzmanngasse 5, A-1090 Vienna, Austria.

出版信息

J Phys Chem B. 2013 Jul 11;117(27):8283-92. doi: 10.1021/jp4037099. Epub 2013 Jun 21.

Abstract

A coarse-grained computational model is used to investigate the effect of a fluctuating fluid membrane on the dynamics of patchy-particle assembly into virus capsid-like cores. Results from simulations for a broad range of parameters are presented, showing the effect of varying interaction strength, membrane stiffness, and membrane viscosity. Furthermore, the effect of hydrodynamic interactions is investigated. Attraction to a membrane may promote assembly, including for subunit interaction strengths for which it does not occur in the bulk, and may also decrease single-core assembly time. The membrane budding rate is strongly increased by hydrodynamic interactions. The membrane deformation rate is important in determining the finite-time yield. Higher rates may decrease the entropic penalty for assembly and help guide subunits toward each other but may also block partial cores from being completed. For increasing subunit interaction strength, three regimes with different effects of the membrane are identified.

摘要

采用粗粒化计算模型研究了脉动流体膜对形成类似病毒衣壳的斑粒子组装成核心的动力学的影响。给出了广泛参数范围内的模拟结果,展示了不同相互作用强度、膜刚度和膜粘性的影响。此外,还研究了流体动力学相互作用的影响。对膜的吸引力可能会促进组装,包括对于在本体中不会发生的亚基相互作用强度,也可能会缩短单个核心的组装时间。流体动力学相互作用强烈地增加了膜出芽的速度。膜变形率在确定有限时间产率中非常重要。较高的速率可能会降低组装的熵罚,并有助于引导亚基相互靠近,但也可能阻止部分核心完成。随着亚基相互作用强度的增加,确定了三种不同的膜影响的状态。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/54f6/3711127/8b59561f701a/jp-2013-037099_0002.jpg

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