Files
LPP/examples/test_rasmol.py
danielque 539fd060c2 python 3 compatibility for examples/*.py files
add from __future__ import
print statement -> print() function
xrange -> range
map() -> list(map())
range() -> list(range())
StandardError -> Exception
2023-08-10 13:25:36 +02:00

22 lines
492 B
Python

# simple test of rasmol tool
# requires files/dump.peptide and files/peptide.pdb
# creates tmp*.pdb and tmp*.gif
d = dump("files/dump.peptide")
d.unwrap()
p = pdbfile("files/peptide",d)
r = rasmol(p)
r.file = "tmp"
print("kill image window when ready to contine ...")
r.show(0)
r.all()
# change RasMol settings, run all() with those settings
print("change RasMol settings as desired, then type 'quit' ...")
r.run(0)
r.all("tmp.rasmol")
print("all done ... type CTRL-D to exit Pizza.py")