Namespaces
	pyrosetta.toolbox.load_ligand

Functions
def	pyrosetta.toolbox.load_ligand.load_from_pubchem (cid, sdffilename="")
	methods for obtaining ligand chemical files and producing params .files More...

def	pyrosetta.toolbox.load_ligand.sdf2mdl (sdfile, mdlfilename)

def	pyrosetta.toolbox.load_ligand.molfile2params_quick (mdlfile, name)

def	pyrosetta.toolbox.load_ligand.params_from_pubchem (cid, name)

def	pyrosetta.toolbox.load_ligand.add_cid_to_database (cid, name)

def	pyrosetta.toolbox.load_ligand.pose_from_pubchem (cid, name, temporary=True)
	returns a pose of the molecule More...

def	pyrosetta.toolbox.load_ligand.pose_from_params (filename, params_list)

Variables
	pyrosetta.toolbox.load_ligand.database = os.path.abspath(os.environ["PYROSETTA_DATABASE"])
	Permanent solution, add the .params to the minirosetta_database of PyRosetta. More...

string	pyrosetta.toolbox.load_ligand.fa_standard = database + "/chemical/residue_type_sets/fa_standard/"

string	pyrosetta.toolbox.load_ligand.fa_custom = "residue_types/custom"

Detailed Description

Namespaces