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The Solvent-Excluding Surface as a descriptor of ionic channels: Gramicidin-A

✍ Scribed by Juan Luis Pascual-Ahuir; Estanislao Silla; Iñaki Tuñón


Book ID
114142789
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
643 KB
Volume
426
Category
Article
ISSN
0166-1280

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GEPOL: An improved description of molecu
✍ J. L. Pascual-ahuir; E. Silla; I. Tuñon 📂 Article 📅 1994 🏛 John Wiley and Sons 🌐 English ⚖ 947 KB

## Abstract To understand and calculate the interactions of a solute with a solvent, a good method of computing the molecular surface is needed. Three kinds of surfaces may be used: the van der Waals Surface, the Accessible Surface, and the Molecular Surface. The latter is redefined in this article