Computing committors in collective variables via Mahalanobis diffusion maps (Q2689136)
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scientific article; zbMATH DE number 7661145
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| English | Computing committors in collective variables via Mahalanobis diffusion maps |
scientific article; zbMATH DE number 7661145 |
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Computing committors in collective variables via Mahalanobis diffusion maps (English)
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9 March 2023
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diffusion map
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collective variables
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committor
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anisotropic diffusion
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Alanine dipeptide
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Lennard-Jones
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0.82434475
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0.80246246
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0.80076134
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0.7997469
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0.7988016
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0.79687047
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