% IMPORTANT: The following is UTF-8 encoded. This means that in the presence
% of non-ASCII characters, it will not work with BibTeX 0.99 or older.
% Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or
% “biber”.
@ARTICLE{Capelli:865794,
author = {Capelli, Riccardo and Carloni, Paolo and Camilloni, Carlo
and Bonomi, Massimiliano and Tribello, Gareth and Bussi,
Giovanni},
title = {{P}romoting transparency and reproducibility in enhanced
molecular simulations},
journal = {Nature methods},
volume = {16},
number = {8},
issn = {1548-7105},
address = {London [u.a.]},
publisher = {Nature Publishing Group},
reportid = {FZJ-2019-05101},
pages = {670 - 673},
year = {2019},
abstract = {The PLUMED consortium unifies developers and contributors
to PLUMED, an open-source library for enhanced-sampling,
free-energy calculations and the analysis of molecular
dynamics simulations. Here, we outline our efforts to
promote transparency and reproducibility by disseminating
protocols for enhanced-sampling molecular simulations.},
cin = {IAS-5 / INM-9},
ddc = {610},
cid = {I:(DE-Juel1)IAS-5-20120330 / I:(DE-Juel1)INM-9-20140121},
pnm = {89574 - Theory, modelling and simulation (POF2-89574)},
pid = {G:(DE-HGF)POF2-89574},
typ = {PUB:(DE-HGF)16},
pubmed = {pmid:31363226},
UT = {WOS:000477857700006},
doi = {10.1038/s41592-019-0506-8},
url = {https://juser.fz-juelich.de/record/865794},
}