Global optimization for molecular clusters using a new smoothing approach

DOI10.1023/A:1008387208683zbMath0962.90052OpenAlexW1827240010MaRDI QIDQ1580443

Elizabeth Eskow, Chung-Shang Shao, Robert B. Schnabel, Byrd, Richard H.

Publication date: 21 June 2001

Published in: Journal of Global Optimization (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1023/a:1008387208683

zbMATH Keywords

global optimizationsmoothing techniquesmolecular chemistryLennard-Jones problems

Mathematics Subject Classification ID

Approximation methods and heuristics in mathematical programming (90C59) Molecular physics (81V55) Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Related Items (4)

Learning mixture models via component-wise parameter smoothing ⋮ Gradient-free method for nonsmooth distributed optimization ⋮ An application of a global optimization parametrization method on macromolecular structure problem ⋮ A note on global optimization via the heat diffusion equation

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