Revision history of "Conversion between different data file formats"

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  • curprev 13:42, 13 May 2019Adk44 talk contribs 1,056 bytes +1,056 Created page with "==== For AMBER ==== xyz -> inpcrd awk '{printf("%12.7f %11.7f %11.7f "), $1, $2, $3} {getline} {printf("%11.7f %11.7f %11.7f\n"), $1, $2, $3}' input.xyz > input.inpcr..."