Project ID: plumID:19.076
Name: Efficient conversion of chemical energy into mechanical work by Hsp70 chaperones
Keywords: molecular chaperones, Hsp70, protein folding, non equilibrium thermodynamics
PLUMED version: 2.1
Contributor: Salvatore Assenza
Submitted on: 21 Oct 2019
Last revised: 25 Jan 2020
Publication: S. Assenza, A. S. Sassi, R. Kellner, B. Schuler, P. De Los Rios, A. Barducci, Efficient conversion of chemical energy into mechanical work by Hsp70 chaperones. eLife. 8 (2019)
PLUMED input files
Last tested: 22 Jun 2022, 17:56:39
Project description and instructions
The Plumed script introduces a harmonic potential with moving center to perform steered Molecular Dynamics. This script is called by the main simulation script in.mix1 (located in the same folder), which implements the simulation in LAMMPS (tested on v. 10Aug15), built as described in IDP_potential_lammps/README. More info here.
[v1] 21 Oct 2019: original submission
[v2] 25 Jan 2020: updated doi
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