- work out how to deal with symmetry
- add more elements to list 19F, Silicon, etc :: completed
- add save option :: completed
- add new option :: completed
- take xy positions from smiles input molecules as starting positions for overlaying nodes
- use info from rdkit about the molecule to map place nodes over guess molecule
- carbonyl atoms
- methyl carbons
- aromatic carbons
- hose codes for ppm
- could calculate expected cosy
- could calculate expected hsqc
- could calculate expected hmbc patterns
- error message when dragging cursor over molecule plot, but not on a node
- fixed 12-8-2022
- zoom in molecule plot crashes program :: Fixed
- add window so that smiles image can be rotated for a better viewing angle in 2D representation
- start off program from taking info from hsqc and hmbc rather than directlyt from 1D carbon and proton
- save final assignments in human readable report
- view and edit original excel sheets
- add logging so that we can see what was done in the program
- add j-coupling values in pop-ups
- use pylint to clean up code
- work on documentation
- add NOESY information
- create c13 plot that looks like a dept with color coded for quarternary carbons
- create a psuedo representation of 2D data that is interactive with molecule highlighting
- develop peak picking algorithms for self contained program
- improve input from excel sheets: cope with missing bits like ranges on proton data :: Fixed