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DENOPTIM
Package denoptim.molecularmodeling

Classes

class  ChemicalObjectModel
 Collector of molecular information, related to a single chemical object, that is deployed within the 3D builder. More...
 
class  MMBuilderUtils
 Utilities for molecular models builder. More...
 
class  MultiMolecularModelBuilder
 
class  RingClosureTool
 Toolkit to perform ring closing conformational search. More...
 
class  ThreeDimTreeBuilder
 Tool to build build three-dimensional (3D) tree-like molecular structures from DGraph. More...
 
class  ThreeDimTreeBuilderTest
 Unit test for TreeBuilder3D. More...