VMD-L Mailing List

From: Zachary SMITH (16.zdsmith_at_gmail.com)
Date: Sat Jul 23 2022 - 12:20:13 CDT

Hello,

I think you are looking for “protein or resname LIG”.

Your version is saying <I want the selection “protein” and (within the selection “protein”) “resname LIG” >.
But “protein” does not contain “resname LIG”, so it shows nothing.

Best,
Zachary

Obtener Outlook para iOS<https://aka.ms/o0ukef>
________________________________
De: owner-vmd-l_at_ks.uiuc.edu <owner-vmd-l_at_ks.uiuc.edu> en nombre de I. Camps <icamps_at_gmail.com>
Enviado: Saturday, July 23, 2022 12:13:55 PM
Para: vmd-l_at_ks.uiuc.edu <vmd-l_at_ks.uiuc.edu>
Asunto: vmd-l: << multiple atom selection >>

Hello,

I loaded a trajectory file from a molecular dynamics run with DESMOND.

I can do individual atom selection but not combinations:
- this works: protein
- this works: resname LIG
- this doesn't work: protein and resname LIG

I am using VMD for LINUXAMD64, version 1.9.4a55.

Suggestions are welcome!

[]'s,

Camps