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Rosetta
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#include <core/chemical/gasteiger/GasteigerAtomTypeData.hh>#include <core/chemical/Element.hh>#include <core/chemical/ElementSet.hh>#include <core/chemical/gasteiger/util.hh>#include <core/types.hh>#include <devel/init.hh>#include <utility/vector1.hh>#include <numeric/util.hh>#include <utility/excn/Exceptions.hh>#include <fstream>Functions | |
| utility::vector1< core::chemical::ElementCOP > | initialize_elements () |
| utility::vector1< core::chemical::gasteiger::GasteigerAtomTypeDataCOP > | initialize_atoms (core::chemical::ElementSetCOP ele_set) |
| int | main (int argc, char *argv[]) |
| utility::vector1< core::chemical::gasteiger::GasteigerAtomTypeDataCOP > initialize_atoms | ( | core::chemical::ElementSetCOP | ele_set | ) |
References utility::get_undefined_real(), and erraser_single_res_analysis::out.
Referenced by main().
| utility::vector1< core::chemical::ElementCOP > initialize_elements | ( | ) |
References basic::options::OptionKeys::chemical::chemical, utility::get_undefined_size(), and erraser_single_res_analysis::out.
Referenced by main().
| int main | ( | int | argc, |
| char * | argv[] | ||
| ) |