29 #ifndef EEMRDKIT_H_SEPT2017
30 #define EEMRDKIT_H_SEPT2017
32 #ifdef RDK_BUILD_DESCRIPTORS3D
35 namespace Descriptors {
41 unsigned int *Atomindex;
42 unsigned int *EEMatomtype;
44 EEM_arrays() =
delete;
45 EEM_arrays(
const EEM_arrays &) =
delete;
46 void operator=(
const EEM_arrays &) =
delete;
48 EEM_arrays(
const ROMol &mol,
unsigned int n);
53 const std::string EEMVersion =
"1.0.0";