Project ID: plumID:19.038
Name: native state dynamics of human and mouse b2m
Archive: https://github.com/carlocamilloni/papers-data/raw/master/zip-for-nest/2019/achour2019_mb2m.zip
Category: bio
Keywords: metainference, NMR, chemical shifts, metadynamics, protein dynamics, aggregation
PLUMED version: 2.4
Contributor: Carlo Camilloni
Submitted on: 07 May 2019
Publication: submitted

PLUMED input files

File Compatible with
achour2019_mb2m/hb2m/plumed.dat tested on v2.5 tested on master
achour2019_mb2m/mb2m/plumed.dat tested on v2.5 tested on master

Last tested: 18 Aug 2019, 14:16:44

Project description and instructions
this is a metadynamic metainference calculation using chemical shifts to infere and compare the native state dynamics of the human and mouse b2-microglobulin. This is performed using multi replicas (at least 8) and gromacs 2016.x or newer

Submission history
[v1] 07 May 2019: original submission

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plumeDnest:19.038