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Updated: Jan 18, 2026

Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
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狭窄液体分子動力学軌道の解析パッケージDynoPore

Samanvitha Kunigal Vijaya Shankar1, Christopher P Ewels1, Yann Claveau1

  • 1Nantes Université, CNRS, Institut des Matériaux de Nantes Jean Rouxel, IMN, F-44000 Nantes, France.

Journal of chemical information and modeling
|January 16, 2026
PubMed

キーワード:
狭窄液体分子動力学Pythonパッケージイオン伝導性細孔幾何学

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Capillarity describes the movement of liquid in small spaces without external forces acting on it. The capillarity is driven by surface tension and adhesive interactions between the liquid and surrounding solid surfaces. This effect is often seen in narrow tubes, porous materials, and fine particles.
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Membrane Fluidity

Cell membranes are composed of phospholipids, proteins, and carbohydrates loosely attached to one another through chemical interactions. Molecules are generally able to move about in the plane of the membrane, giving the membrane its flexible nature called fluidity. Two other features of the membrane contribute to membrane fluidity: the chemical structure of the phospholipids and the presence of cholesterol in the membrane.
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