Project ID: plumID:20.030
Name: Converging experimental and computational views of the knotting mechanism of the smallest knotted protein
Archive: https://zenodo.org/record/4196336/files/PLUMED_NEST_MJ0366.zip
Category: bio
Keywords: phi-values, transition state, knotted proteins
PLUMED version: 2.6
Contributor: Cristina Paissoni
Submitted on: 02 Nov 2020
Publication: unpublished

PLUMED input files

File Compatible with
plumed0.dat tested on v2.7 tested on master
plumed1.dat tested on v2.7 tested on master
plumed2.dat tested on v2.7 tested on master

Last tested: 25 Nov 2020, 11:44:40

Project description and instructions
this is a phi-value restrained annealing MD simulations using GROMACS + PLUMED. The restraint strength is increased gradually.

Submission history
[v1] 02 Nov 2020: original submission

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plumeDnest:20.030