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Pitfall in Free-Energy Simulations on Simplest Systems
Kin-Yiu Wong
*
, Yuqing Xu
, Liang Xu
*
Corresponding author for this work
Department of Physics
Research output
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Contribution to journal
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Journal article
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peer-review
94
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Keyphrases
Free Energy Profile
100%
Free Energy Simulation
100%
Simple System
100%
Energy Barrier
33%
Histogram
16%
High Energy
16%
Recent Issues
16%
Scale Factor
16%
Body-subject
16%
Transition State Theory
16%
Jacobian
16%
Thermodynamic Integration
16%
Depth Comparison
16%
Blue Moon
16%
Zero Forcing
16%
Umbrella Sampling
16%
Mean Force
16%
Chemistry
Free Energy
100%
Energy Barrier
16%
Transition State Theory
8%
Earth and Planetary Sciences
Free Energy
100%
Histogram
8%
Biochemistry, Genetics and Molecular Biology
Umbrella Sampling
100%
Chemical Engineering
Free Energy
100%