Path: utzoo!utgpu!news-server.csri.toronto.edu!mailrus!cs.utexas.edu!uunet!mcsun!unido!uklirb!shell
From: imt@computing-maths.cardiff.ac.uk (I M Thomas)
Newsgroups: comp.ai.shells
Subject: Expert Shells in Computational Chemistry.
Keywords: Chemometrics,I.R. Spectra Interpretation,Lisp,Prolog,Shells,Toolkits.
Message-ID: <6362@uklirb.informatik.uni-kl.de>
Date: 4 Aug 90 19:11:02 GMT
Sender: shell@uklirb.informatik.uni-kl.de
Reply-To: I M Thomas <imt@computing-maths.cardiff.ac.uk>
Organization: University of Wales College of Cardiff, Cardiff, WALES, UK.
Lines: 12
Approved: shell@informatik.uni-kl.de
Posted-Date: Wed Aug  8 09:59:18 GMT 1990

Hello people, I'm looking for leads to the use of A.I. in Computational
Chemistry & Chemometrics, in particular for the analysis/interpretation
of Infrared Spectra.This could involve the use of an Expert System Shell,
an A.I. language like Lisp or Prolog, a procedural language,or even a Neural
Net.Other computational methods of massaging the data could be statistical
techniques,& hooks to software methods for calculating, probabilities,
& Bayesian logic.Please post your replies on the network & I will compile
them for re-posting the results.

IAN THOMAS.