def get_dispName_for_writemmp(display): #bruce 080324, revised 080328
"""
Turn a display-style code integer (e.g. diDEFAULT; as stored in
Atom.display or Chunk.display) into a display-style code string
as used in the current writing format for mmp files.
"""
if debug_pref_write_new_display_names():
return new_dispNames[display]
return dispNames[display]
def get_dispName_for_writemmp(display): #bruce 080324, revised 080328
"""
Turn a display-style code integer (e.g. diDEFAULT; as stored in
Atom.display or Chunk.display) into a display-style code string
as used in the current writing format for mmp files.
"""
if debug_pref_write_new_display_names():
return new_dispNames[display]
return dispNames[display]
def write_header(self):
assy = self.assy
# The MMP File Format is initialized here, just before we write the file.
# Mark 050130
# [see also the general notes and history of the mmpformat,
# in a comment or docstring near the top of this file -- bruce 050217]
from utilities.GlobalPreferences import debug_pref_write_new_display_names
if self.write_bonds_compactly:
# soon, this will become the usual case, I hope
mmpformat = MMP_FORMAT_VERSION_TO_WRITE__WITH_COMPACT_BONDS_AND_NEW_DISPLAY_NAMES
elif debug_pref_write_new_display_names():
# this is what will be used by default in NE1 1.0.0,
# as it turned on by default as of now, for writing to all mmp files
# (whether intended for NE1 or NV1; doesn't affect files for ND1)
# [bruce 080410]
mmpformat = MMP_FORMAT_VERSION_TO_WRITE__WITH_NEW_DISPLAY_NAMES
else:
# this case is needed as long as some readers don't yet support
# the new display names (an incompatible change), or if we want
# to retain the ability to write files for older reading code
# such as A9.1 or prior releases.
mmpformat = MMP_FORMAT_VERSION_TO_WRITE
if not (self.sim or self.min):
#bruce 050322 comment: this side effect is questionable when
# self.sim or self.min is True.
#bruce 080328: don't do it then (since it's possible we might soon
# write a different version of this record then).
assy.mmpformat = mmpformat
self.fp.write("mmpformat %s\n" % mmpformat)
if self.min:
self.fp.write(
"# mmp file written by Adjust or Minimize; can't be read before Alpha5\n"
)
elif self.sim:
self.fp.write(
"# mmp file written by Simulate; can't be read before Alpha5\n"
)
if not self.min:
self.fp.write("kelvin %d\n" % assy.temperature)
# To be added for Beta. Mark 05-01-16
## f.write("movie_id %d\n" % assy.movieID)
return
def write_header(self):
assy = self.assy
# The MMP File Format is initialized here, just before we write the file.
# Mark 050130
# [see also the general notes and history of the mmpformat,
# in a comment or docstring near the top of this file -- bruce 050217]
from utilities.GlobalPreferences import debug_pref_write_new_display_names
if self.write_bonds_compactly:
# soon, this will become the usual case, I hope
mmpformat = MMP_FORMAT_VERSION_TO_WRITE__WITH_COMPACT_BONDS_AND_NEW_DISPLAY_NAMES
elif debug_pref_write_new_display_names():
# this is what will be used by default in NE1 1.0.0,
# as it turned on by default as of now, for writing to all mmp files
# (whether intended for NE1 or NV1; doesn't affect files for ND1)
# [bruce 080410]
mmpformat = MMP_FORMAT_VERSION_TO_WRITE__WITH_NEW_DISPLAY_NAMES
else:
# this case is needed as long as some readers don't yet support
# the new display names (an incompatible change), or if we want
# to retain the ability to write files for older reading code
# such as A9.1 or prior releases.
mmpformat = MMP_FORMAT_VERSION_TO_WRITE
if not (self.sim or self.min):
# bruce 050322 comment: this side effect is questionable when
# self.sim or self.min is True.
# bruce 080328: don't do it then (since it's possible we might soon
# write a different version of this record then).
assy.mmpformat = mmpformat
self.fp.write("mmpformat %s\n" % mmpformat)
if self.min:
self.fp.write("# mmp file written by Adjust or Minimize; can't be read before Alpha5\n")
elif self.sim:
self.fp.write("# mmp file written by Simulate; can't be read before Alpha5\n")
if not self.min:
self.fp.write("kelvin %d\n" % assy.temperature)
# To be added for Beta. Mark 05-01-16
## f.write("movie_id %d\n" % assy.movieID)
return
