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Dead-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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Document Date: 2010-09-08 02:56:25

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City

Kortrijk / Pasadena / /

Company

John Wiley & Sons Inc. / Dead-End Elimination N. A. / AlgoNomics NV / /

Country

Belgium / /

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Event

Man-Made Disaster / /

Facility

Howard Hughes Medical Institute / California Institute of Technology / Campus Kortrijk / /

IndustryTerm

actual minimum energy / minimum energy / side-chain placement algorithms / lower net energy contribution / energy profiles / net energy contribution resulting / conformational energy / energy corresponding / minimum energy conformation / elimination algorithms / lower energy / energy landscapes / side chains / exhaustive search / deterministic approach / net energy contribution / energy contributions / sample energy profiles / energy terms / energy / /

Organization

Department of Applied Mathematics / California Institute of Technology / Belgian National Fund for Scientific Research / Faculty of Agricultural and Applied Biological Sciences / Division of Biology / Burroughs-Wellcome Foundation / California Interdisciplinary Research Center / Howard Hughes Medical Institute / /

Person

PIERCE ET AL / /

Position

General / candidate it rotamers / /

ProvinceOrState

California / /

PublishedMedium

JOURNAL OF COMPUTATIONAL CHEMISTRY / the JOURNAL OF COMPUTATIONAL CHEMISTRY / /

Technology

side-chain placement algorithms / Computational Chemistry / elimination algorithms / two algorithms / eight R10000 processors / /

SocialTag