Is there a way to save a trajectory during minimization instead of a single rst7 file at the end?
Alex Lee
PhD Student
Woods Research Group<
https://woodsgroup.franklinresearch.uga.edu/>
Department of Biochemistry & Molecular Biology
Complex Carbohydrate Research Center
University of Georgia
315 Riverbend Rd.
Athens, GA 30602
Email: ahl63010.uga.edu
Mobile: (470) 641-3884
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Received on Mon Oct 07 2024 - 12:00:02 PDT
