I am working on a project where we are looking for a computational tool to explore the occurrence of combustion products (organic molecules) when heating different kinds of plants in a controlled manner. Let's say what the possible organic compound formation will be when we heat, e.g., Mangifera indica, at 250 degrees Celsius. Is there any computational tool or method available to carry out this kind of work?
Your response will be highly appreciated.
We are also open to collaboration.
Thanks and Regards
Braham
To predict the formation of organic compounds when heating different plants in controlled combustion, you would typically use analytical techniques like gas chromatography-mass spectrometry (GC-MS) or Fourier-transform infrared spectroscopy (FTIR). These methods can identify and quantify the organic compounds produced during combustion, helping you understand the chemical composition of the plants' decomposition products. Additionally, you may need to consider factors such as temperature, heating rate, and the presence of catalysts to better predict compound formation.
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