nmr::pre Namespace Reference

Functions
BooleanOptionKey const	pre ("nmr:pre")
FileOptionKey const	input_file ("nmr:pre:input_file")
IntegerOptionKey const	nls_repeats ("nmr:pre:nls_repeats")
BooleanOptionKey const	optimize_para_ion_position ("nmr:pre:optimize_para_ion_position")
RealVectorOptionKey const	multiset_weights ("nmr:pre:multiset_weights")
BooleanOptionKey const	normalize_data ("nmr:pre:normalize_data")
BooleanOptionKey const	use_symmetry_calc ("nmr:pre:use_symmetry_calc")
BooleanOptionKey const	show_info ("nmr:pre:show_info")

Function Documentation

FileOptionKey const nmr::pre::input_file

(

"nmr:pre:input_file"

)

RealVectorOptionKey const nmr::pre::multiset_weights

(

"nmr:pre:multiset_weights"

)

IntegerOptionKey const nmr::pre::nls_repeats

(

"nmr:pre:nls_repeats"

)

BooleanOptionKey const nmr::pre::normalize_data

(

"nmr:pre:normalize_data"

)

BooleanOptionKey const nmr::pre::optimize_para_ion_position

(

"nmr:pre:optimize_para_ion_position"

)

BooleanOptionKey const nmr::pre::pre

(

"nmr:pre"

)

BooleanOptionKey const nmr::pre::show_info

(

"nmr:pre:show_info"

)

BooleanOptionKey const nmr::pre::use_symmetry_calc

(

"nmr:pre:use_symmetry_calc"

)