import IMP import IMP.display class Display(object): """Store Display""" def __init__(self): self._children = list() def create_log(self, repr, log_name): """Create Chimera log. @param repr Representation object. @param log_name Log name @return IMP::display::WriteOptimizerState""" # Try to create Chimera log (like in display_log.py example) log = IMP.display.WriteOptimizerState(IMP.display.ChimeraWriter(log_name)) # Find IMP particle that corresponds to a representation id for child in self._children: child.find_model_decorator(repr) # Detach parents and children, so the geometries are separate (so that # we can set separate colors) for child in self._children: child.detach_parent() # Add geometries of proper colors to the log for child in self._children: child.create_xyz(1.0, 1.0, 1.0, log) # Reunite parents with children for child in self._children: child.attach_parent() return log def __str__(self): return '\n%s\n' %\ ('\n'.join([child._to_str(1) for child in self._children])) class _DisplayNode(object): counter = 0 def __init__(self, attributes): id = attributes.get('id') if id: self.id = id else: self.id = 'object_%d' % _DisplayNode.counter _DisplayNode.counter += 1 self._children = list() def get_color(self): for child in self._children: if isinstance(child, _DisplayColor): return child return None def find_model_decorator(self, repr): particle = repr.find_by_id(self.id) if particle and particle.model_decorator: self.model_decorator = particle.model_decorator else: self.model_decorator = None for child in self._children: child.find_model_decorator(repr) def detach_parent(self): if self.model_decorator: self.parent = self.model_decorator.get_parent() self.parent.remove_child(self.model_decorator) for child in self._children: child.detach_parent() def attach_parent(self): if self.model_decorator: self.parent.add_child(self.model_decorator) for child in self._children: child.attach_parent() def create_xyz(self, r, g, b, log): color = self.get_color() if color: r = color.r g = color.g b = color.b atom_list = list() if self.model_decorator: atoms = IMP.atom.get_by_type(self.model_decorator, IMP.atom.XYZR_TYPE) for atomh in atoms: for atom in IMP.atom.get_leaves(atomh): atom_list.append(atom) if len(atom_list) >0: c = IMP.container.ListSingletonContainer(atom_list) geometry = IMP.core.XYZRsGeometry(c) geometry.set_name(self.id) geometry.set_color(IMP.display.Color(r, g, b)) log.add_geometry(geometry) for child in self._children: child.create_xyz(r, g, b, log) def _attr_to_str(self): return ('DisplayNode', 'id="%s"' % self.id) def _to_str(self, level): indent = ' '*level name, strattr = self._attr_to_str() if not self._children: return '%s<%s %s/>' % (indent, name, strattr) else: return '%s<%s %s>\n%s\n%s' %\ (indent, name, strattr, '\n'.join([child._to_str(level + 1) for child in self._children]), indent, name) def __str__(self): return self._to_str(0) class _DisplayColor(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) self.r = float(attributes.get('r', 0)) self.g = float(attributes.get('g', 0)) self.b = float(attributes.get('b', 0)) def _attr_to_str(self): return ('Color', 'id="%s" r="%s" g="%s" b="%s"' % (self.id, self.r, self.g, self.b)) class _DisplayResidue(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) self.start = int(attributes.get('start', -1)) self.end = int(attributes.get('end', -1)) def _attr_to_str(self): return ('Residue', 'id="%s" start="%s" end="%s"' % (self.id, self.start, self.end)) class _DisplayUniverse(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Universe', 'id="%s"' % self.id) class _DisplayCollection(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Collection', 'id="%s"' % self.id) class _DisplayAssembly(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Assembly', 'id="%s"' % self.id) class _DisplaySegment(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Segment', 'id="%s"' % self.id) class _DisplayMolecule(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Molecule', 'id="%s"' % self.id) class _DisplayProtein(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Protein', 'id="%s"' % self.id) class _DisplayNucleicAcid(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('NucleicAcid', 'id="%s"' % self.id) class _DisplayChain(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Chain', 'id="%s"' % self.id) class _DisplayFragment(_DisplayNode): def __init__(self, attributes): _DisplayNode.__init__(self, attributes) def _attr_to_str(self): return ('Fragment', 'id="%s"' % self.id)