QMRITools`
QMRITools`
GetSpectraBasisFunctions
GetSpectraBasisFunctions[{met1, …,metn}]
generates a list of spectra baisis functions with names met1 to metn. The names are strings and are the metabolites availible in GetSpinSystem.
GetSpectraBasisFunctions[{{props1}, …,{propsn}}]
generates a list of spectra baisis functions with properties prop1 to propn. The properties are those specified in MakeSpinSystem.
GetSpectraBasisFunctions[inp,split]
generates a list of spectra basisfunctions. Each metabolite name present in the list split wil be split in individual spectra per peak.
Details
- The following options can be given:
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BasisSequence {PulseAcquire, 0} BasisSequence is an option for GetSpectraBasisFunctions and specifies which sequence to use. SpectraSamples 2046 SpectraSamples is an option for GetSpectraBasisFunctions and sets the number of samples in the spectra. SpectraBandwith 2000 SpectraBandwith is an option for GetSpectraBasisFunctions and sets the bandwith of the spectra. SpectraNucleus "1H" SpectraNucleus is an option for GetSpectraBasisFunctions and FitSpectra and specifies which nucleus to Simulate or fit, see GyromagneticRatio. SpectraPpmShift 4.65 SpectraPpmShift is an option for GetSpectraBasisFunctions and FitSpectra and defines how much the center frequency is shifted, default is water at 4.65 ppm. SpectraFieldStrength 3 SpectraFieldStrength is an option for GetSpectraBasisFunctions and FitSpectra and sets the field strenght at which the simulations and fitting is perforemd.