Multiwfn forum / cp2k output trajectory convert to pdb

Re: cp2k output trajectory convert to pdb

dummy@example.com (taha55) — Fri, 30 Sep 2022 11:39:49 +0000

Thank you Dear Prefessor
Best Regards

dummy@example.com (sobereva) — Thu, 29 Sep 2022 23:18:20 +0000

In the interface of opening new file, choose "load all at once" before clicking "Load", the loading time will be significantly reduced.

dummy@example.com (taha55) — Thu, 29 Sep 2022 20:36:53 +0000

Thank you Dear Prefessor

I know what you said, but it takes hours to open vmd xyz file at 100000 frames. How to do it differently from VMD?

dummy@example.com (sobereva) — Thu, 29 Sep 2022 20:20:24 +0000

Load it into VMD, and select "Save coordinate" to save the trajectory to pdb format.

dummy@example.com (taha55) — Thu, 29 Sep 2022 19:54:18 +0000

Hi
How to convert output trajectory(Molecular_dynamic.xyz file) to pdb format?
Regards