☆ 4.6 Article

Open-source molecular modeling software in chemical engineering focusing on the Molecular Simulation Design Framework

AICHE JOURNAL (2021)

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Journal

AICHE JOURNAL
Volume 67, Issue 3, Pages -

Publisher

WILEY
DOI: 10.1002/aic.17206

Keywords

adsorption/gas; computer simulations (MC and MD); simulation; molecular; thermodynamics/statistical

Categories

Engineering, Chemical

Funding

  1. National Science Foundation [OAC-1835874, OAC-1835612, OAC-1835630, OAC-1835067, OAC-1835613, OAC-1835593, OAC-1835713, OAC-1835560]

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