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Parses the output file from lammps and calculates the mean distance from the initial position for every atom in molecule

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ErikPitko/lammps-parser

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lammps-parser (bestScript)

Parses the LAMMPS output trajectory file and calculates the mean square distance from the initial state for every/selected atoms in the system. Possibility to calculate the whole distance an atom has travelled.

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Parses the output file from lammps and calculates the mean distance from the initial position for every atom in molecule

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