OEReadCIFGridFile

bool OEReadCIFGridFile( const std::string &filename, OESystem::OESkewGrid &sgrid,
                unsigned int maptype )

Read a structure factor CIF file into an OpenEye skew grid. The grid requires that the proper column name be present to extract the appropriate reflection data.

The following map types can be read using predefined operations on the sfCIF data:

MapType	Description
OEMTZMapType_Fo	Observed Reflections
OEMTZMapType_Fc	Map generated from calculated model
OEMTZMapType_TwoFoFc	2Fo - Fc
OEMTZMapType_ThreeFoTwoFc	3Fo - Fc
OEMTZMapType_FiveFoThreeFc	5Fo - 3Fc
OEMTZMapType_TwoFoFcSigmaA	2Fo - Fc Sigma-A weighted
OEMTZMapType_FoFcSigmaA	Fo - Fc Sigma-A weighted
OEMTZMapType_FoSquared	Fo*Fo
OEMTZMapType_FoFom	Fo * figure of merit
OEMTZMapType_Fwt	2mFo - DFc (normally)
OEMTZMapType_Fdelwt	mFo - DFc (normally)
OEMTZMapType_None	No reflections (used as a status flag)