Respected Sir/Madam
I want to read the frequencies for primay reaction . I have only species file only. how to calculate. please do the needful.
Thanking you
Respected Sir/Madam
I want to read the frequencies for primay reaction . I have only
species file only. how to calculate. please do the needful.
please explain in more detail what property you are after. your inquiry
makes no sense to me. it sounds like you want to do some specific post
processing. most likely, you will have to write a script/program that does
that for your specific case.
axel.