Project ID: plumID:19.042
Name: Harmonic Linear Discriminant Analysis (HLDA)
Keywords: metadynamics, chemistry, HLDA
PLUMED version: 2.3
Contributor: GiovanniMaria Piccini
Submitted on: 08 May 2019
Publication: D. Mendels, G. Piccini, M. Parrinello, Collective Variables from Local Fluctuations, The Journal of Physical Chemistry Letters 9, 2776–2781 (2018)
PLUMED input files
Last tested: 12 May 2021, 10:19:41
Project description and instructions
HLDA example for a Diels-alder reaction in vacuum. A detailed explanation of the repository can be found here.
[v1] 08 May 2019: original submission
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