Molecular Surface Maps

We present Molecular Surface Maps, a novel, view-independent, and concise representation for molecular surfaces. It transfers the well-known world map metaphor to molecular visualization. Our application maps the complex molecular surface to a simple 2D representation through a spherical intermediat...

Ausführliche Beschreibung

Bibliographische Detailangaben
Veröffentlicht in:IEEE transactions on visualization and computer graphics. - 1996. - 23(2017), 1 vom: 03. Jan., Seite 701-710
1. Verfasser: Krone, Michael (VerfasserIn)
Weitere Verfasser: Friess, Florian, Scharnowski, Katrin, Reina, Guido, Fademrecht, Silvia, Kulschewski, Tobias, Pleiss, Jurgen, Ertl, Thomas
Format: Online-Aufsatz
Sprache:English
Veröffentlicht: 2017
Zugriff auf das übergeordnete Werk:IEEE transactions on visualization and computer graphics
Schlagworte:Journal Article Research Support, Non-U.S. Gov't
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520 |a We present Molecular Surface Maps, a novel, view-independent, and concise representation for molecular surfaces. It transfers the well-known world map metaphor to molecular visualization. Our application maps the complex molecular surface to a simple 2D representation through a spherical intermediate, the Molecular Surface Globe. The Molecular Surface Map concisely shows arbitrary attributes of the original molecular surface, such as biochemical properties or geometrical features. This results in an intuitive overview, which allows researchers to assess all molecular surface attributes at a glance. Our representation can be used as a visual summarization of a molecule's interface with its environment. In particular, Molecular Surface Maps simplify the analysis and comparison of different data sets or points in time. Furthermore, the map representation can be used in a Space-time Cube to analyze time-dependent data from molecular simulations without the need for animation. We show the feasibility of Molecular Surface Maps for different typical analysis tasks of biomolecular data 
650 4 |a Journal Article 
650 4 |a Research Support, Non-U.S. Gov't 
700 1 |a Friess, Florian  |e verfasserin  |4 aut 
700 1 |a Scharnowski, Katrin  |e verfasserin  |4 aut 
700 1 |a Reina, Guido  |e verfasserin  |4 aut 
700 1 |a Fademrecht, Silvia  |e verfasserin  |4 aut 
700 1 |a Kulschewski, Tobias  |e verfasserin  |4 aut 
700 1 |a Pleiss, Jurgen  |e verfasserin  |4 aut 
700 1 |a Ertl, Thomas  |e verfasserin  |4 aut 
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