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Results of search for 'au:"Bohner, Matthias U"'
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Authors
Arnold, Axel
Bohner, Matthias U
Kästner, Johannes
Markmeyer, Max N
Meisner, Jan
Smiatek, Jens
Zeman, Johannes
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Algorithms
Dipeptides
Models, Molecular
Molecular Dynamics Simulation
Thermodynamics
chemistry
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1.
An algorithm to find minimum free-energy paths using umbrella integration.
[electronic resource]
by
Bohner, Matthias U
Kästner, Johannes
Producer:
20121127
In:
The Journal of chemical physics
vol. 137
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Available from publisher's website
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2.
A Quadratically-Converging Nudged Elastic Band Optimizer.
[electronic resource]
by
Bohner, Matthias U
Meisner, Jan
Kästner, Johannes
Producer:
20151124
In:
Journal of chemical theory and computation
vol. 9
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Available from publisher's website
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3.
Comparison of classical reaction paths and tunneling paths studied with the semiclassical instanton theory.
[electronic resource]
by
Meisner, Jan
Markmeyer, Max N
Bohner, Matthias U
Kästner, Johannes
Producer:
20180205
In:
Physical chemistry chemical physics : PCCP
vol. 19
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4.
Nudged-elastic band used to find reaction coordinates based on the free energy.
[electronic resource]
by
Bohner, Matthias U
Zeman, Johannes
Smiatek, Jens
Arnold, Axel
Kästner, Johannes
Producer:
20141014
In:
The Journal of chemical physics
vol. 140
Online resources:
Available from publisher's website
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