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Searched defs:calcdesc (Results 1 – 3 of 3) sorted by relevance

/dports/science/openbabel/openbabel-3.1.1/scripts/php/
H A Dbaphpel.php335 public function calcdesc($descnames = array()) { function in baphpel\\Molecule
/dports/science/openbabel/openbabel-3.1.1/scripts/python/openbabel/
H A Dpybel.py450 def calcdesc(self, descnames=[]): member in Molecule
/dports/science/py-oddt/oddt-0.7/oddt/toolkits/
H A Drdk.py1023 def calcdesc(self, descnames=None): member in Molecule