In the category of "something we wish we always had" I woke up this
morning with the realization that with a "bit of work" we should be able
to give multiple load commands without losing the currently loaded file,
and thus add or append structures to a model or set of models.
Yes, well, 10 hours later I do believe Jmol 11.1.22 introduces that.
load APPEND "filename".....
and
data "APPEND"....end "APPEND";
add new model data, creating a new model (or not) in the process,
depending on the setting of
set appendNew
By default, data are loaded into a new model. But when appendNew is set
FALSE, then the data is introduced into the currently displayed model.
For example:
set appendNew false
load caffeine.xyz
>FileManager opening caffeine.xyz
>The Resolver thinks Xyz
>openFile(caffeine.xyz,0,0,0,0)0 ms
>frame: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false
>1 model in this collection....
load append cholesterol.mol
>FileManager opening cholesterol.mol
>The Resolver thinks Mol
>openFile(cholesterol.mol,0,0,0,0)219 ms
>frame: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false
>1 model in this collection.
select molecule=1
>24 atoms selected
select molecule=2
>74 atoms selected
set appendNew true
load append 1crn.pdb
select 1.1
>98 atoms selected
select 2.1
>327 atoms selected
select helix
>162 atoms selected
OR
load caffeine.xyz
isosurface plane {1 1 1 0} translucent 3
set appendnew false
data "append"
2
test
C 0 0 0
O 1 1 1
end "append";
I now have caffeine.xyz plus CO together, in one model.
Still probably needs some testing, but it even looks like the state
business is working.
Bob
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