- Docente: Assimo Maris
- Credits: 6
- SSD: CHIM/06
- Language: English
- Moduli: Maria De Lurdes Dos Santos Cristiano (Modulo 1) Axel Bidon-Chanal Badia (Modulo 2) Assimo Maris (Modulo 3)
- Teaching Mode: In-person learning (entirely or partially) (Modulo 1); In-person learning (entirely or partially) (Modulo 2); In-person learning (entirely or partially) (Modulo 3)
- Campus: Bologna
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Corso:
Second cycle degree programme (LM) in
Chemistry (cod. 8856)
Also valid for Second cycle degree programme (LM) in Chemistry (cod. 8856)
Second cycle degree programme (LM) in Chemistry (cod. 8856)
Learning outcomes
At the end of the course the student will know the problems of discovering and designing new pharmaceutically active substances and patenting their production and use. He will know how to apply computational tools for the forecast of the bio-pharmacological and environmental properties of new chemicals. The student is expected to be able to: 1. Design and discover new drugs; 2. Apply the principles of patenting and intellectual property rights to design and development of new chemical products ; 3. Use the tools of QSAR for the forecast of the properties of new drugs.
Course contents
The course is an introduction to computational methods applied to the tackling of chemical problems with emphasis on the relation between structure and chemical properties (biological activity and toxicity). The emphasis will be on the rational design of new molecules of chemical, biological and pharmacological interest and on the toxicity of chemicals.
Readings/Bibliography
Andrew R. Leach "Molecular modelling: principles and applications"
Prentice Hall
"Chemoinformatics: A Textbook" Edited by Johann Gasteiger and
Thomas Engel, Wiley-VCH Verlag GmbH & Co
Lecture notes
Teaching methods
Lectures and computer laboratory.
Assessment methods
Written and informatic exam.
Teaching tools
Lectures and computer laboratory.
Office hours
See the website of Assimo Maris
See the website of Maria De Lurdes Dos Santos Cristiano
See the website of Axel Bidon-Chanal Badia