Identification of Highest Priority functional group in organic molecules
Input is Fourier Transform Infrared spectral image, which is resized to (224,224) pixels shape.
In the code, the images are taken from a HDF5 file which contains the pixel information of all the images.
Data can be collected from Spectral Database for Organic Compounds
After pre-processing(removing finger-print region) and resizing, the input passed to CNN :