INFO-B 572 Computational Chemistry and Molecular Modeling
- Prerequisites: INFO I571
- Delivery: On-Campus
Computer models of molecules and their behavior in gas and condensed phases; implicit and explicit solvation models; quantum and molecular mechanics; search strategies for conformational analysis; geometry optimization methods; information content from Monte Carlo and molecular dynamics simulations; QSAR; CoMFO; docking.
There is not a syllabus available for this course.