AI helps you reading Science
AI generates interpretation videos
AI extracts and analyses the key points of the paper to generate videos automatically
Go Generating
AI Traceability
AI parses the academic lineage of this thesis
A Unified Electrostatic And Cavitation Model For First-Principles Molecular Dynamics In Solution
JOURNAL OF CHEMICAL PHYSICS, no. 7 (2006): 74103-74103
WOS
Keywords
Abstract
The electrostatic continuum solvent model developed by [Fattebert and Gygi J. Comput. Chem. 23, 662 (2002); Int. J. Quantum Chem. 93, 139 (2003)] is combined with a first-principles formulation of the cavitation energy based on a natural quantum-mechanical definition for the surface of a solute. Despite its simplicity, the cavitation cont...More
Code:
Data:
Tags
Comments
数据免责声明
页面数据均来自互联网公开来源、合作出版商和通过AI技术自动分析结果，我们不对页面数据的有效性、准确性、正确性、可靠性、完整性和及时性做出任何承诺和保证。若有疑问，可以通过电子邮件方式联系我们：report@aminer.cn