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I am M.S. Pharmacoinformatics 2nd sem.student at NIPER.
I am working on the use of Artificial Neural Network to validate the
QSAR of the compounds.
I need the IC50 values of various compounds. Can I have the list along
with the relation to rate constant.
wishing for ur kind concent.
sincerly
avantika_niper.at.yahoo.com
AVANTIKA AGRAWAL
M.S(PHARMACOINFORMATICS)
National Institute of Pharmaceutical Education & Research (NIPER),
Ph. 214684
Mohali,Punjab (INDIA)-160062
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The following message was posted to: PharmPK
i think the question is something lacking. As we all
know that through QSAR we will try to relate the a
known actvity to the structural properties or
descriptors for the structure.
Now, in my view first try to line up your choice of
category and then search out a number of compounds
with a good variation in the activity, which can be
explained using normal distribution.
For this you can list out a number of compounds
already synthesized and evaluated for their activity.
These can be easily available journals in JMC, EJMC,
BMCL, BMC.
My next view is since you wish to use Neural networking,
the advanced technique build to define more firm
relationship, so you must choose a variety of
compounds having different basic nucleus.
Regards
Vineet Singh
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