Molecular arrangement and fringe identification and analysis from molecular dynamics (MAFIA-MD): A tool for analyzing the molecular structures formed during reactive molecular dynamics simulation of hydrocarbons - researchr publication

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Khaled Mosharraf Mukut, Somesh Roy, Eirini Goudeli. Molecular arrangement and fringe identification and analysis from molecular dynamics (MAFIA-MD): A tool for analyzing the molecular structures formed during reactive molecular dynamics simulation of hydrocarbons. Computer Physics Communications, 276:108325, 2022. [doi]

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