Articles with "molecular surfaces" as a keyword



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Parametric representation of molecular surfaces

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Published in 2019 at "International Journal of Quantum Chemistry"

DOI: 10.1002/qua.25695

Abstract: This article is dedicated to the computation of a parametric representation of solvent excluded surfaces and isosurfaces by smooth four-sided patches. Such surface representations allow for the isoparametric discretization of the boundary integral equations which… read more here.

Keywords: parametric representation; representation molecular; molecular surfaces; chemistry ... See more keywords
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Exploring the science of thinking independently together: Faraday Discussion Volume 204 - Complex Molecular Surfaces and Interfaces, Sheffield, UK, July 2017.

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Published in 2017 at "Chemical communications"

DOI: 10.1039/c7cc90389h

Abstract: The 2017 Faraday Discussion on Complex Molecular Surfaces and Interfaces brought together theoreticians and experimentalists from both physical and chemical backgrounds to discuss the relevant applied and fundamental research topics within the broader field of… read more here.

Keywords: molecular surfaces; complex molecular; exploring science; faraday discussion ... See more keywords
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Ellipsoidal Abstract and Illustrative Representations of Molecular Surfaces

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Published in 2019 at "International Journal of Molecular Sciences"

DOI: 10.3390/ijms20205158

Abstract: Molecular visualization is often challenged with rendering of large molecular structures in real time. The key to LOD (level-of-detail), a classical technology, lies in designing a series of hierarchical abstractions of protein. In the paper,… read more here.

Keywords: representations molecular; ellipsoidal abstract; illustrative representations; molecular surfaces ... See more keywords