Multibaric–multithermal molecular dynamics simulation: generalized Nosé–Poincaré–Andersen method (Q3445897)
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scientific article; zbMATH DE number 5162269
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| English | Multibaric–multithermal molecular dynamics simulation: generalized Nosé–Poincaré–Andersen method |
scientific article; zbMATH DE number 5162269 |
Statements
Multibaric–multithermal molecular dynamics simulation: generalized Nosé–Poincaré–Andersen method (English)
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7 June 2007
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molecular dynamics simulation
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multibaric-multithermal algorithm
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symplectic integrator
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alanine dipeptide
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0.7991031408309937
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0.7579739689826965
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0.7332454323768616
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0.7143709063529968
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0.6749524474143982
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