Thanks Rajarshi. I have updated the wiki page:
http://onschallenge.wikispaces.com/MeltingPointModel011 The fragments with
coefficients can be found here:
http://onschallenge.wikispaces.com/file/view/mpC.txt
>From the wiki page, your model has a number of non-significant features. Have
>you considered dropping those?
On Fri, Jul 6, 2012 at 10:05 AM, Andrew Lang <gameshon...@hotmail.com> wrote:
Hi Guys:
Following Noel's post:
http://baoilleach.blogspot.com/2012/03/it-all-adds-up-to-new-descriptor.html
I've developed a melting point model that can be used in OpenBabel - test-set
R2: 0.67, AAE: 43.6, and RMSE: 58.1 - see attached for plugin file.
Details can be found here:
http://onschallenge.wikispaces.com/MeltingPointModel011
Thanks,
Andy
Andrew SID LangProfessor of MathematicsGC1E08Oral Roberts UniversityTulsa,
OK74171
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