I am experimenting with an Amber set of files (topology + coordinates
from a molecular dynamics calculation).
The files load fine into Jmol (load trajectory) but I cannot get any
cartoons or trace renderings.
Is this a limitation with the TRAJECTORY option, or a problem with
the Amber format?
Possibly related to this:
I cannot select atoms based on atom name
e.g.
select Lys # 88 atoms selected
select Lys and *.CA # 0 atoms selected
select Lys and alpha # 0 atoms selected
Hover displays them correct
label %a # works fine
try sending them to me at hans...@stolaf.edu. Might be ok.
2011/2/3 Angel Herráez angel.herr...@uah.es
I am experimenting with an Amber set of files (topology + coordinates
from a molecular dynamics calculation).
The files load fine into Jmol (load trajectory) but I cannot get any
cartoons
3 matches
Mail list logo