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      From: Robert H. <ha...@st...> - 2025-10-16 18:49:02
      
     
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If you have separate frames, which I think you do, just make sure you use select 1.1 write "1.1.mol" or something similar to that to select only the one frame. If you have the frame as the current frame, you can use: select this or (as long as all the atoms are visible) select visible Bob On Thu, Oct 16, 2025 at 12:37 PM John Keller via Jmol-users < jmo...@li...> wrote: > I have a large trajectory file as .xyz and I need to save one frame as a > .mol file. I swear I have done this before, but now when I try this, either > nothing is selected, or the whole trajectory is saved. Any suggestions? > _______________________________________________ > Jmol-users mailing list > Jmo...@li... > https://lists.sourceforge.net/lists/listinfo/jmol-users > -- Robert M. Hanson Professor of Chemistry, Emeritus St. Olaf College Northfield, MN http://www.stolaf.edu/people/hansonr If nature does not answer first what we want, it is better to take what answer we get. -- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900 *We stand on the homelands of the Wahpekute Band of the Dakota Nation. We honor with gratitude the people who have stewarded the land throughout the generations and their ongoing contributions to this region. We acknowledge the ongoing injustices that we have committed against the Dakota Nation, and we wish to interrupt this legacy, beginning with acts of healing and honest storytelling about this place.*  |