Goodman-lab / DP5

Python workflow for DP5 and DP4 analysis of organic molecules
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What does 'total_params' represent? #78

Open mertyrdkl opened 1 year ago

mertyrdkl commented 1 year ago

Hello,

I have been working on the DP4-AI/DP5 package and looking at the code for automatic proton NMR elucidation. One of the outputs of process_proton fuction is called _'totalparams' which I am having hard time interpreting it. Would appreciate if I can get some explanation about it. Thank you! @HowarthA