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scoring_grid Directory Reference
Directory dependency graph for scoring_grid:
src/protocols/qsar/scoring_grid

Files

file  AtrGrid.cc [code]
 
file  AtrGrid.fwd.hh [code]
 
file  AtrGrid.hh [code]
 
file  AtrGridCreator.hh [code]
 
file  ChargeGrid.cc [code]
 This is an implementation of equation 3 in Goodford, J. Med. Chem. 1985,28,849-857. doi:10.1021/jm00145a002.
 
file  ChargeGrid.fwd.hh [code]
 
file  ChargeGrid.hh [code]
 This is an implementation of equation 3 in Goodford, J. Med. Chem. 1985,28,849-857. doi:10.1021/jm00145a002.
 
file  ChargeGridCreator.hh [code]
 
file  ClassicGrid.cc [code]
 
file  ClassicGrid.fwd.hh [code]
 
file  ClassicGrid.hh [code]
 
file  ClassicGridCreator.hh [code]
 
file  ConstantScoreBase.fwd.hh [code]
 
file  ConstantScoreBase.hh [code]
 this is a base class for defining constant terms which are computed over an entire ligand rather than on a per atom basis The unneeded functions are stubbed out, everything left is pure virtual.
 
file  GridBase.fwd.hh [code]
 
file  GridBase.hh [code]
 
file  GridCreator.cc [code]
 
file  GridCreator.hh [code]
 Base class for GridCreators for the Grid load time factory registration scheme.
 
file  GridFactory.cc [code]
 
file  GridFactory.fwd.hh [code]
 
file  GridFactory.hh [code]
 
file  GridInitMover.cc [code]
 
file  GridInitMover.fwd.hh [code]
 
file  GridInitMover.hh [code]
 
file  GridInitMoverCreator.hh [code]
 
file  GridManager.cc [code]
 
file  GridManager.fwd.hh [code]
 
file  GridManager.hh [code]
 
file  HbaGrid.cc [code]
 
file  HbaGrid.fwd.hh [code]
 
file  HbaGrid.hh [code]
 
file  HbaGridCreator.hh [code]
 
file  HbdGrid.cc [code]
 
file  HbdGrid.fwd.hh [code]
 
file  HbdGrid.hh [code]
 
file  HbdGridCreator.hh [code]
 
file  LigandPropertyScore.cc [code]
 
file  LigandPropertyScore.fwd.hh [code]
 
file  LigandPropertyScore.hh [code]
 
file  LigandPropertyScoreCreator.hh [code]
 
file  RepGrid.cc [code]
 
file  RepGrid.fwd.hh [code]
 
file  RepGrid.hh [code]
 
file  RepGridCreator.hh [code]
 
file  ScoreNormalization.cc [code]
 Header file for Score Normalization methods.
 
file  ScoreNormalization.fwd.hh [code]
 report data to database
 
file  ScoreNormalization.hh [code]
 Header file for Score Normalization methods.
 
file  ScoringGridLoader.cc [code]
 
file  ScoringGridLoader.fwd.hh [code]
 
file  ScoringGridLoader.hh [code]
 
file  ScoringGridLoaderCreator.hh [code]
 Creator classes for the default DataLoader classes, TaskOperationLoader and ScoreFunctionLoader.
 
file  ShapeGrid.cc [code]
 
file  ShapeGrid.fwd.hh [code]
 
file  ShapeGrid.hh [code]
 
file  ShapeGridCreator.hh [code]
 
file  SingleGrid.cc [code]
 
file  SingleGrid.fwd.hh [code]
 
file  SingleGrid.hh [code]
 
file  SolvationGrid.cc [code]
 
file  SolvationGrid.fwd.hh [code]
 
file  SolvationGrid.hh [code]
 
file  SolvationGridCreator.hh [code]
 
file  SolvationMetaGrid.cc [code]
 
file  SolvationMetaGrid.fwd.hh [code]
 
file  SolvationMetaGrid.hh [code]
 
file  SolvationMetaGridCreator.hh [code]
 
file  VdwGrid.cc [code]
 
file  VdwGrid.fwd.hh [code]
 
file  VdwGrid.hh [code]
 
file  VdwGridCreator.hh [code]