37#ifndef WHIMRDKIT_H_SEPT2016
38#define WHIMRDKIT_H_SEPT2016
40#ifdef RDK_BUILD_DESCRIPTORS3D
43namespace Descriptors {
44const std::string WHIMVersion =
"1.0.0";
46 int confId = -1,
double th = 0.001,
47 const std::string &customAtomPropName =
"");
#define RDKIT_DESCRIPTORS_EXPORT