Computer Aided Drug Design detailed syllabus for Pharmaceutical Technology (Pharma Tech) for 2019 regulation curriculum has been taken from the Anna Universities official website and presented for the Pharma Tech students. For course code, course name, number of credits for a course and other scheme related information, do visit full semester subjects post given below.
For Pharmaceutical Technology 5th Sem scheme and its subjects, do visit Pharma Tech 5th Sem 2019 regulation scheme. For Professional Elective-II scheme and its subjects refer to Pharma Tech Professional Elective-II syllabus scheme. The detailed syllabus of computer aided drug design is as follows.
Course Objective:
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Unit I
Stereochemistry and Drug Design
Structurally Rigid Groups – Conformation – Configuration, Introduction to Drug Discovery and Development: Stages of drug discovery and development, Drug properties and Databases, Introduction to Virtual Screening
Unit II
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Unit III
Quantitative Structure – Activity Relationship
QSAR- Pharmacophore based approach, Scaffold hopping ,Target based design, Partitional parameters – partition coefficients – hepo substituent constants – electronic parameters -Hammet constant steric parameters – Hansch analysis
Unit IV
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Unit V
Molecular Simulations
Introduction to Molecular Dynamic Simulations – Force Field, Energy Minimisation, Introduction to GROMACS – Setup, run MD Simulation of a Protein and Analyse the results
Course Outcome:
For the complete syllabus, results, class timetable, and many other features kindly download the iStudy App
It is a lightweight, easy to use, no images, and no pdfs platform to make students’s lives easier..
Text Books:
- Patrick Bultinck , Hans De Winter , Wilfried Langenaeker, Jan P. Tollenare, Computational Medicinal Chemistry for Drug Discovery 1st Edition Marcel Dekker Inc. , 2004
- Andrew R. Leach Molecular Modeling Principles and Applications (2nd Ed.). Prentice Hall ,2009
- Cohen, N.C. “Guide Book on Molecular Modeling in Drug Design”, Academic Press / Elsevier, 2006
- Eliel, E.L. “StereoChemistry of Organic Compounds”, John Wiley, 1994.
References:
- Frenkel, Dean and Berend Smith “Understanding Molecular Simulation: From Algorithms to Applications”, 2nd Edition Academic Press, 2002.
- Lee, Mike S. “Integrated Strategies for Drug Discovery using Mass Spectrometry” John Wiley – Interscience, 2005.
For detailed syllabus of all the other subjects of Pharmaceutical Technology 5th Sem, visit Pharma Tech 5th Sem subject syllabuses for 2019 regulation.
For all Pharmaceutical Technology results, visit Anna University Pharma Tech all semester results direct link.