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Data · dataset · 2025

Replication data for: Efeitos de íon-comum e múltiplos eletrólitos na solvatação de proteínas por líquidos iônicos

Listed in REDU - Unicamp Institutional Research Data Repository

Description

(i) a dataset containing input and output files for a molecular dynamics simulation of the ionic liquid BMIMCl at 1.0 mol/L in the presence of the protein Ubiquitin, illustrating one replica representative of the simulations performed in the thesis; (ii) input models used to run the molecular dynamics simulations with the OPLS-VSIL force field and the GROMACS software;

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Where it is published

Catalogue records · 1

Topics

Stated by source
Chemistry
From keywords
Chemistry · Life Sciences
Provenance · 1 source records, 11 field assertions
SourceKeyLast seenRaw
REDU - Unicamp Institutional Research Data Repositorydoi:10.25824/redu/YKFGL012 d agoJSON v1
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