Re: [Rdkit-discuss] Developing on Visual C++

2009-02-21 Thread George Oakman
Hi, Thanks for trying with gcc. When I compile and link with bjam and toolset=msvc it works for me too, but it is when I try to complie using the build process integrated with Visual C++ Express that I get the runtime error. It would be very kind if you could let me have your

Re: [Rdkit-discuss] Optimizing SSS in the RDKit

2009-02-21 Thread Andrew Dalke
On Feb 17, 2009, at 8:30 PM, Andrew Dalke wrote: Thanks for the link. I've read [Andrew Smellie's] paper now. It's very nicely written, clear, with good background, description, and results, ... Andrew Smellie didn't take what I thought would be the obvious next step and use a trie (probably

Re: [Rdkit-discuss] Developing on Visual C++

2009-02-21 Thread Igor Filippov [Contr]
George, Sure, here it is (I named your file t.cpp): g++ -c -I ../rdkit-svn/Code -I ../rdkit-svn/External/vflib-2.0/include/ -I ../boost_1_37_0 t.cpp export LD_LIBRARY_PATH=../rdkit-svn/bin/ g++ -o t t.o -L ../rdkit-svn/bin/ -lRDGeneral -lGraphMol -lRDGeometry ./t [12:37:07] Hello RDKit