Presentation 2006-01-27
Real time visualization of transformed molecular orbital isosurface according to molecular skeleton deformation
Takatoshi NAKA, Mamoru ENDO, Masashi YAMADA, Shinya MIYAZAKI, Yasuyo HATANO, Shigeyoshi YAMAMOTO,
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Abstract(in English) This paper realizes visualization of the metamorphosis of molecular orbital according to interaction of molecular frame distortion. Chemists are given a great help in analyzing the mechanism of chemical reaction. Molecular orbital is represented by a voxel data set that is obtained by solving differential equations numerically, and is rendered as a iso-surface. To display continuous results according to interaction, a novel method is introduced. Key volume data sets are sampled according to the bending of the molecular skeleton and a pair of key volume data sets is blended in the rendering process for improvement in the speed.
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Keyword(in English) molecular orbital / real-time / visible draw / iso-surface
Paper # MVE2005-63
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Conference Information
Committee MVE
Conference Date 2006/1/19(1days)
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Registration To Media Experience and Virtual Environment (MVE)
Language JPN
Title (in Japanese) (See Japanese page)
Sub Title (in Japanese) (See Japanese page)
Title (in English) Real time visualization of transformed molecular orbital isosurface according to molecular skeleton deformation
Sub Title (in English)
Keyword(1) molecular orbital
Keyword(2) real-time
Keyword(3) visible draw
Keyword(4) iso-surface
1st Author's Name Takatoshi NAKA
1st Author's Affiliation Graduate School of Computer and Cognitive Sciences, Chukyo University()
2nd Author's Name Mamoru ENDO
2nd Author's Affiliation School of Computer and Cognitive Sciences, Chukyo University
3rd Author's Name Masashi YAMADA
3rd Author's Affiliation School of Computer and Cognitive Sciences, Chukyo University
4th Author's Name Shinya MIYAZAKI
4th Author's Affiliation School of Computer and Cognitive Sciences, Chukyo University
5th Author's Name Yasuyo HATANO
5th Author's Affiliation School of Computer and Cognitive Sciences, Chukyo University
6th Author's Name Shigeyoshi YAMAMOTO
6th Author's Affiliation Faculty of Liberal Arts, Chukyo University
Date 2006-01-27
Paper # MVE2005-63
Volume (vol) vol.105
Number (no) 566
Page pp.pp.-
#Pages 6
Date of Issue