Informing Spectroscopists for Over 40 Years

Tony Davies Columns

A.N. Davies,a H.M. Heiseb and D.F. Ihrigc

aProfessor, SERC, University of Glamorgan, UK, Director, ALIS Ltd, and ALIS GmbH—Analytical Laboratory Informatics Solutions
bISAS—Institute for Analytical Sciences at Dortmund University of Technology, Bunsen-Kirchhoff-Str. 11, D-44139 Dortmund, Germany
cUniversity of Applied Sciences of South-Westphalia, Frauenstuhlweg 31, D-58644 Iserlohn, Germany

Tony Davies

Norwich Near Infrared Consultancy, 75 Intwood Road, Cringleford, Norwich NR4 6AA, UK

Fans of “Monty Python’s Flying Circus” will realise that what follows is not likely to be my usual column (and they might be hoping that it will be amusing).

Introduction

This column is about “Computational Chemistry”.

A.N. Davies

Professor, SERC, Department of Science and Sport, Faculty Health, Sport and Science, University of Glamorgan, UK, Director, ALIS Ltd, and ALIS GmbH—Analytical Laboratory Informatics Solutions

Opportunities

I would like to thank everybody who has taken the trouble to respond to my last column on Educating Spectroscopists.1 I am very happy that Ian has allowed me space to reproduce some of them in this edition.

Tony Daviesa and Tom Fearnb

aNorwich Near Infrared Consultancy , 75 Intwood Road, Cringleford, Norwich NR4 6AA, UK
bDepartment of Statistical Science, University College London, Gower Street, London WC1E 6BT, UK

A.N. Davies

External Professor, University of Glamorgan, UK, Director, ALIS Ltd, and ALIS GmbH – Analytical Laboratory Informatics Solutions

“And the light shineth in darkness; and the darkness comprehended it not.”

King James Bible, John 1:5

A.M.C. Davies

Norwich Near Infrared Consultancy, 75 Intwood Road, Cringleford, Norwich NR4 6AA, UK. E-mail: td@nnirc.co.uk

Tom Fearn

Department of Statistical Science, University College London, Gower Street, London WC1E 6BT, UK. E-mail: tom@stats.ucl.ac.uk

Antony Neil Daviesa and Jörg Ingo Baumbachb

aExternal Professor, University of Glamorgan, UK. Director, ALIS Ltd, and ALIS GmbH–Analytical Laboratory Informatics Solutions
bISAS–Institute for Analytical Sciences, Metabolomics Department, Bunsen-Kirchhoff-Str. 11, 44139 Dortmund, Germany

A.M.C. Daviesa and Tom Fearnb

aNorwich Near Infrared Consultancy, 75 Intwood Road, Cringleford, Norwich NR4 6AA, UK. E-mail: td@nnirc.co.uk
bDepartment of Statistical Science, University College London, Gower Street, London WC1E 6BT, UK. E-mail: tom@stats.ucl.ac.uk

Antony Neil Daviesa and Martin Gerlachb

aExternal Professor, University of Glamorgan, UK. Director, ALIS Ltd, and ALIS GmbH–Analytical Laboratory Informatics Solutions
bVice President, PMT Process Analyzer Technology, Bayer Technology Services GmbH, Leverkusen, Germany

A.M.C. Davies

Norwich Near Infrared Consultancy, 75 Intwood Road, Cringleford, Norwich NR4 6AA, UK. E-mail: td@nnirc.co.uk

Tom Fearn

Department of Statistical Science, University College London, Gower Street, London WC1E 6BT, UK. E-mail: tom@stats.ucl.ac.uk

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