Hi,
Apologies if this is a rudimentary question. I'd like to display an internal
binding pocket around a compound as a surface (or mesh). I don't need to detect
the presence of a cavity but simply show its approximate boundaries.
1. Is there a way to display the cavity as a surface about
y
output: ... Executive: RMSD =4.030 (10847 to 10847 atoms)
cmd: print(cmd.align("x", "y"))
output: (4.0296430587768555, 10847, 5, 24.87837028503418, 13476, 1234.0, 1192)
Bests, Tamas
On 2023. 03. 02. 8:54, Irwin Selvam wrote:
Hi,
I would like to run the Align Python
Hi,
I would like to run the Align Python script found on the Align page of the
PyMOLwiki (https://pymolwiki.org/index.php/Align). I've tweaked it slightly for
my uses and it seems to run fine on PyMOL 2.5.0 but according to the wiki it
should output a list of results (RMSD etc) in the internal