Cpptraj finds a syntax error in the following expression …
rmsd first [:28-35.CA & :79-87.CA & :90-98.CA & :
102-108.CA]
What I want : do a superposition of a series of MD frames using the CA atoms of residues 28-35, 79-89, 90-98 and 102-108
Erik R.P. Zuiderweg
Professor Emeritus
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Received on Sat Jun 10 2023 - 08:00:02 PDT
