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IGLOO: An Iterative Global Exploration and Local Optimization Algorithm to Find Diverse Low-Energy Conformations of Flexible Molecules

William Margerit, Antoine Charpentier, Cathy Maugis-Rabusseau, Johann Christian Schön, Nathalie Tarrat, Juan Cortés. IGLOO: An Iterative Global Exploration and Local Optimization Algorithm to Find Diverse Low-Energy Conformations of Flexible Molecules. Algorithms, 16(10):476, 2023. [doi]

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William Margerit

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Antoine Charpentier

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Cathy Maugis-Rabusseau

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Johann Christian Schön

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Nathalie Tarrat

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Juan Cortés

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