Re: [PyMOL] Viewing trajectories in pymol

2018-11-21 Thread Istvan Kolossvary
Yes, when it comes to trajectory visualization, vmd is just much better than Pymol. intra_fit can be used for example this way: print cmd.intra_fit("my-trajCA", 1) where my-traj is an object with all the frames and the macro in quotes can be used to define any selection, in this example CA ato

Re: [PyMOL] Viewing trajectories in pymol

2018-11-21 Thread Floris van Eerden
Dear Ivan, Thanks for the suggestion. However it has the same result as what I tried before. The slider does the job, but is not responsive enough for intense scrolling through trajectories (not sure if it is because the rendering take to much CPU or because the slider is just not designed for

Re: [PyMOL] Viewing trajectories in pymol

2018-11-21 Thread KurtYilmaz, Nese
Hi, What is the best way to align the snapshots of a trajectory when viewing in pymol? Is it possible to align using a selection, say on a few selected residues? Nese From: Istvan Kolossvary [ikolos...@gmail.com] Sent: Tuesday, November 20, 2018 11:43 PM To: py

[PyMOL] Pandas module in Pymol

2018-11-21 Thread Andreas Tosstorff
Hi all, I am trying to use pandas in a script in pymol. These are the first lines of the script: from pymol import cmd, stored, math import pandas as pd I get the following error message when running the script: 'module 'pandas' has no attribute 'plotting' File "/home/andt88/anaconda3/lib/p