Conformational isomerism

Results: 81



#Item
41Atomic physics / Rotation / Rotational spectroscopy / Conformational isomerism / Hyperfine structure / Energy level / Gauche effect / Infrared spectroscopy / Chemistry / Spectroscopy / Stereochemistry

WD01 15:00 – 15:17 STUDIES ON THE CONFORMATIONAL LANDSCAPE OF TERT-BUTYL ACETATE USING MICROWAVE SPECTROSCOPY AND QUANTUM CHEMICAL CALCULATIONS Y. Zhao1, H. Mouhib1, G. Li1, W. Stahl1, I. Kleiner2 1

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Source URL: www.chem.uni-wuppertal.de

Language: English - Date: 2014-09-26 11:54:45
42Dead-end elimination / Mathematical optimization / Bioinformatics / Stereochemistry / Conformational isomerism / Protein design / Resolution / STING / Homology modeling / Chemistry / Protein methods / Protein structure

Exact Rotamer Optimization for Protein Design D. BENJAMIN GORDON,1 GEOFFREY K. HOM,2 STEPHEN L. MAYO,3 NILES A. PIERCE4 1 Whitehead Institute for Biomedical Research, Cambridge, Massachusetts[removed]Biochemistry Option, C

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Source URL: piercelab.caltech.edu

Language: English - Date: 2010-09-08 02:56:26
43Dead-end elimination / Mathematical optimization / Bioinformatics / Stereochemistry / Conformational isomerism / Protein design / STING / Homology modeling / Computational chemistry / Chemistry / Protein methods / Protein structure

Conformational Splitting: A More Powerful Criterion for Dead-End Elimination N. A. PIERCE,1,∗ J. A. SPRIET,2 J. DESMET,2,† S. L. MAYO3 1 Division of Biology, California Institute of Technology, Pasadena, California

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Source URL: piercelab.caltech.edu

Language: English - Date: 2010-09-08 02:56:25
44Bioinformatics / Protein structure prediction / Dead-end elimination / Conformational isomerism / Protein folding / Energy / Simulated annealing / Rosetta@home / Chemistry / Protein structure / Protein methods

LNBI[removed]Minimizing and Learning Energy Functions for Side-Chain Prediction

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Source URL: www.cs.huji.ac.il

Language: English - Date: 2008-05-01 09:48:13
45Transition metals / Carborane / Cluster chemistry / Superacids / Molecular motor / Bis(cyclooctadiene)nickel / Nickel / Ni / Conformational isomerism / Chemistry / Molecular machines / Stereochemistry

Microsoft Word - Rotary Molecular Motors.doc

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Source URL: www.nanomed.missouri.edu

Language: English - Date: 2012-03-26 16:55:59
46Benzene / Mutagens / Occupational safety and health / Cyclohexane / Deoxyribose / Alkane stereochemistry / Conformational isomerism / Aromatic ring current / Chemistry / Stereochemistry / Cycloalkanes

preface Preface Slngle ~ r y s t a lX-ray crystallographic studles on nuclelc acld const~tuentshave prov~deda wealth of information on their conformational flexlbillty, geometry and nature of ~nteractlons Thls thesis pr

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Source URL: etd.ncsi.iisc.ernet.in

Language: English - Date: 2012-12-03 00:57:24
47ICAN / SOX2 / Microphthalmia / American Printing House for the Blind / Conformational isomerism / Autism / Chemistry / Health / Anophthalmia

Fall 2011 ICAN The Conformer ICAN[removed]ican / [removed] / http://www.anophthalmia.org/

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Source URL: www.anophthalmia.org

Language: English - Date: 2013-05-27 13:19:16
48Insect repellents / Stereochemistry / Physical organic chemistry / Conformational isomerism / DEET / Icaridin / Isomer / Hybrid functional / Root-mean-square deviation / Chemistry / Household chemicals / Isomerism

SAR and QSAR in Environmental Research, Vol. 18, Nos. 3–4, May–June 2007, 237–250 Three dimensional structure-activity relationships (3D-QSAR) for insect repellency of diastereoisomeric compounds: a hierarchical mo

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Source URL: www.afpmb.org

Language: English - Date: 2009-07-31 09:47:02
49Bioinformatics / Stereochemistry / Molecular modelling / Conformational isomerism / Molecular dynamics / Alpha helix / X-ray crystallography / Conformational change / Loop modeling / Chemistry / Protein structure / Protein methods

Accessing protein conformational ensembles using room-temperature X-ray crystallography James S. Frasera,1, Henry van den Bedemb, Avi J. Samelsona, P. Therese Langa, James M. Holtonc,d, Nathaniel Echolsd, and Tom Albera,

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Source URL: mpec.ucsf.edu

Language: English - Date: 2011-11-09 21:09:37
50Dead-end elimination / Conformational isomerism / Dynamic programming / Protein structure prediction / Self-consistent mean field / Chemistry / Protein methods / Mathematical optimization

Protein Side-chain Placement through MAP Estimation and Problem-Size Reduction Eun-Jong Hong and Tom´ as Lozano-P´erez Computer Science and Artificial Intelligence Lab, MIT, Cambridge, MA 02139, USA

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Source URL: people.csail.mit.edu

Language: English - Date: 2012-06-11 20:15:10
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