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New approaches to potential energy minimization and molecular dynamics algorithms
Tamar Schlick
Chemistry
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peer-review
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Dive into the research topics of 'New approaches to potential energy minimization and molecular dynamics algorithms'. Together they form a unique fingerprint.
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Mathematics
Dynamic Algorithms
100%
Energy Minimization
94%
Molecular Dynamics
93%
Truncated Newton Method
75%
Implicit Scheme
49%
Langevin Dynamics
35%
Quadratic Convergence
27%
Euler Scheme
26%
Energy Function
25%
Numerical Stability
25%
Separability
24%
Potential Function
24%
Term
24%
Discrimination
24%
Second derivative
23%
Minimization Problem
21%
Convergence Rate
19%
Nonlinear Systems
18%
Energy
15%
Formulation
14%
Simulation
14%
Range of data
13%
Engineering & Materials Science
Potential energy
75%
Newton-Raphson method
50%
Potential energy functions
36%
Convergence of numerical methods
28%
Cutoff frequency
26%
Nonlinear systems
19%
Derivatives
18%
Chemical Compounds
Potential Energy
69%
Molecular Dynamics
50%
Medicine & Life Sciences
Molecular Dynamics Simulation
76%