Temperature–energy-space sampling molecular dynamics: deterministic and single-replica method utilizing continuous temperature system (Q5870646)
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scientific article; zbMATH DE number 7644745
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| English | Temperature–energy-space sampling molecular dynamics: deterministic and single-replica method utilizing continuous temperature system |
scientific article; zbMATH DE number 7644745 |
Statements
Temperature–energy-space sampling molecular dynamics: deterministic and single-replica method utilizing continuous temperature system (English)
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23 January 2023
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molecular dynamics
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coupled Nosé-Hoover equation
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enhanced sampling
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temperature system
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invariant measure
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0.7005258202552795
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0.6825721263885498
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0.6782123446464539
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0.6705589890480042
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0.6610451340675354
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