Back to Results
First PageMeta Content
Surfaces / Geometric topology / Topology / Physical organic chemistry / Cyclohexane conformation / Conformational isomerism / Alkane / Klein bottle / Möbius strip / Chemistry / Organic chemistry / Stereochemistry


THE JOURNAL OF CHEMICAL PHYSICS 132, 234115 共2010兲 Topology of cyclo-octane energy landscape Shawn Martin,1,a兲 Aidan Thompson,2 Evangelos A. Coutsias,3 and Jean-Paul Watson4 1
Add to Reading List

Document Date: 2010-06-21 16:18:54


Open Document

File Size: 1,39 MB

Share Result on Facebook

City

Santos / Albuquerque / Berlin / Wiley / /

Company

Cambridge University Press / Lockheed Martin Co. / Sandia National Laboratories / Sandia Corporation / S. B. Nolde A. S. / /

Country

United States / Wales / /

Currency

USD / /

/

Facility

University of New Mexico / American Institute / American Institute of Physics / /

IndustryTerm

similar energy / term potential energy surface / energy scale / low energy / enumerative algorithms / chemical formula / intersection ring energy minima / typical algorithms / similar tools / incremental surface reconstruction algorithm / predicted energy minima / intramolecular energy / energy landscapes / energy gradient / cyclo-octane energy landscape / potential energy landscape / energy / basic mathematical structure underlying energy landscapes / energy maxima / low energy transition pathways / plastics / energy minimum / energy landscape / term energy landscape / type path searching algorithms / high energy / low energy states / triaxial loop closure algorithm / free energy surface / free energy landscape / energy surface / energy ranges / /

OperatingSystem

Dos / /

Organization

Cambridge University / National Institute of Health / American Institute of Physics / Computer Science Research Fund / Department of Mathematics / United States Department of Energy / University of New Mexico / /

Person

Nat / Eric Cyr / Aidan Thompson / J. Tenenbaum / V / Shawn Martin / Scott Mitchell / /

Position

boat-chair / chair-chair / Author / twist-boat-chair / underlying conformation Author / Governor / chair / twist-chair / /

Product

Isomap / Plex / Elber / using the Elber / /

ProvinceOrState

British Columbia / New York / New Mexico / /

PublishedMedium

THE JOURNAL OF CHEMICAL PHYSICS / /

Technology

x-ray / triaxial loop closure algorithm / computational chemistry / BBs / conformation space.20 / 21 These algorithms / incremental surface reconstruction algorithm / string type path searching algorithms / simulation / /

URL

http /

SocialTag