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Spectral-SpecPro helps with the manipulation of optical spectroscopy data. Spectral takes files produced by Jasco instruments (uv-vis absorbance, fluorescence, circular dichroism readings as a function of wavelength, temperature, or time) and facilitates basic operations such as unit conversion (CD spectra), conversion into the format taken by CDPro (estimation of secondary structure; CD spectra), scatter correction (absorbance spectra), smoothing, re-sampling of the x-axis, and generic combination (sum, product, average, standard deviation) of multiple curves.
Spectral-SpecPro is based on earlier software written by Stephen R Martin (MRC-NIMR London NW7 and Francis Crick Institute London NW1).
Features
- Conversion of CD units
- Data format conversion to CDPro format
- Scatter correction for uv-vis absorbance spectra
- Smoothing and taking derivatives (numerically)
- X-axis resampling
- Combination of multiple curves (summation, multiplication, averaging, computation of standard deviation)
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