| Recommended Reading List |
1. Hinchliffe, A., "Molecular Modeling for Beginners", Wiley, Manchester, UK, 2008.2. Ramachandran, K.I., et al, "Computational Chemistry and Molecular Modeling", Springer, 2008.3. Muchmore, S.W., et al, "Chemoinformatics Tools for Medicinal Chemists", J. Med. Chem. (2010) 53, 4830-4841.4. Schlick, T., "Molecular Modeling and Simulation: An Interdisciplinary Guide" Springer, 2010.5. Redhu, S., Jindal, A.," Molecular Modeling: A New Scaffold for Drug Design, Int J Pharm Pharm Sci (2013) 5, 5-8.6. Scoichet, B.K., et al, "Lead Discovery Using Molecular Docking", Current Opin Chem Biol (2002) 6,439-446. |
| Catalog Content |
Molecular Modeling: Molecular modeling approaches, Examples in drug design, Molecular modeling programs, Interaction analysis, Two-dimensional representation, Three-dimensional representation; Protein Data Bank; Molecular Docking: Ligand preparation, Related crystal selection, Protein preparation, Active site selection, Statistical analysis, Scoring, Molecular docking applications; Molecular Dynamics Simulation: Output analysis, Video analysis, Molecular dynamics applications. |
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