Modeling molecular kinetics with tICA and the kernel trick
about
Computational Membrane Biophysics: From Ion Channels Interactions with Drugs to Cellular Function.Variational Koopman models: Slow collective variables and molecular kinetics from short off-equilibrium simulations.Note: MSM lag time cannot be used for variational model selection.Identification of simple reaction coordinates from complex dynamics.Nonparametric variational optimization of reaction coordinates.Constructing Markov State Models to elucidate the functional conformational changes of complex biomolecules
P2860
Modeling molecular kinetics with tICA and the kernel trick
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2015 nî lūn-bûn
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2015年の論文
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2015年論文
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2015年論文
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2015年論文
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2015年論文
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2015年論文
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2015年论文
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2015年论文
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2015年论文
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name
Modeling molecular kinetics with tICA and the kernel trick
@ast
Modeling molecular kinetics with tICA and the kernel trick
@en
type
label
Modeling molecular kinetics with tICA and the kernel trick
@ast
Modeling molecular kinetics with tICA and the kernel trick
@en
prefLabel
Modeling molecular kinetics with tICA and the kernel trick
@ast
Modeling molecular kinetics with tICA and the kernel trick
@en
P2860
P356
P1476
Modeling molecular kinetics with tICA and the kernel trick
@en
P2093
Christian R Schwantes
Vijay S Pande
P2860
P304
P356
10.1021/CT5007357
P577
2015-01-03T00:00:00Z