Trajectory file of energy minimization of capsid(7f-3.trr)


Creators: Nerukh, Dmitry, Tarasova, Elvira, Farafonov, Vladimir, Korotkin, Ivan and Karabasov, Sergey
Keywords: hybrid atomistic/continuum, multiscale, molecular dynamics, fluctuating hydrodynamics, dialanine, all-atom whole virus simulation, capsid, PCV2
Divisions: College of Engineering and Physical Sciences > Aston Institute of Photonics Technology (AIPT)
Funders: Engineering and Physical Sciences Research Council, Royal Society of London, Royal Society of Chemistry, Royal Academy of Engineering, Leverhulme Trust
Projects: G8 Research Councils Initiative on Multilateral Research Funding
Grant number: EP/J004308/1)
Data Publisher: Aston University
Date Made Available: 24 March 2016
Collection period:
8 June 20159 June 2015
Data Collection and Processing Methods: Dataset underlying publication titled "Two-phase flow analogy as an effective boundary condition for modelling liquids at atomistic resolution"
Identification Number:




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