Hi Greg,

I am trying to use your function to calculate Balaban index J:

doubel dResult = RDKit::MolOps::computeBalabanJ(*mol, true, true, 0, false)

and getting linker problems (see enclosed file). Probably need to  #include
some files?

Can you help please?

Regards,
Evgueni
Error   7       error LNK2019: unresolved external symbol "void __cdecl 
LaEigSolve(class LaSymmMatDouble const &,class LaVectorDouble &)" 
(?LaEigSolve@@YAXABVLaSymmMatDouble@@AAVLaVectorDouble@@@Z) referenced in 
function "class boost::tuples::tuple<double,double,double,struct 
boost::tuples::null_type,struct boost::tuples::null_type,struct 
boost::tuples::null_type,struct boost::tuples::null_type,struct 
boost::tuples::null_type,struct boost::tuples::null_type,struct 
boost::tuples::null_type> __cdecl RDKit::MolOps::computeDiscriminators(double 
*,int,int)" 
(?computediscriminat...@molops@RDKit@@ya?av?$tu...@nnnunull_type@tup...@boost@@u...@u123@u...@u123@u...@u123@@tup...@boost@@pa...@z)
     libGraphMol.lib 
Error   8       error LNK2001: unresolved external symbol "private: static int 
* LaLowerTriangMatDouble::info_" (?in...@lalowertriangmatdouble@@0PAHA)  
libGraphMol.lib 
Error   9       error LNK2019: unresolved external symbol "public: __thiscall 
LaGenMatDouble::LaGenMatDouble(double *,int,int)" 
(??0LaGenMatDouble@@q...@panhh@Z) referenced in function "public: __thiscall 
LaLowerTriangMatDouble::LaLowerTriangMatDouble(double *,int,int)" 
(??0LaLowerTriangMatDouble@@q...@panhh@Z)        libGraphMol.lib 
Error   10      error LNK2019: unresolved external symbol "public: virtual 
__thiscall LaGenMatDouble::~LaGenMatDouble(void)" (??1LaGenMatDouble@@u...@xz) 
referenced in function "public: __thiscall 
LaLowerTriangMatDouble::~LaLowerTriangMatDouble(void)" 
(??1LaLowerTriangMatDouble@@q...@xz)        libGraphMol.lib 
Error   11      error LNK2019: unresolved external symbol "public: __thiscall 
LaGenMatDouble::LaGenMatDouble(int,int)" (??0LaGenMatDouble@@q...@hh@Z) 
referenced in function "public: __thiscall LaVectorDouble::LaVectorDouble(int)" 
(??0LaVectorDouble@@q...@h@Z)     libGraphMol.lib 

Reply via email to