Course Schedule - Spring Semester 2017

     

CHEM 523 001 (CRN: 24100)

MOLECULAR DYNAMICS METHODS

Long Title: ADVANCED ANALYSIS METHODS FOR MOLECULAR DYNAMICS FROM STATISTICAL MECHANICS TO MACHINE LEARNING
Department: Chemistry
Instructor: Clementi, Cecilia
Meeting: 7:00PM - 8:15PM MW KCK 107 (27-FEB-2017 - 21-APR-2017) 
Session: 2nd Half of Full Term
Grade Mode: Standard Letter
Course Type: Lecture
Language of Instruction: Taught in English
Method of Instruction: Face to Face
Credit Hours: 1.5
Course Syllabus:
Course Materials: Rice Campus Store
 
Restrictions:
Must be enrolled in one of the following Level(s):
Graduate
Section Max Enrollment: 30
Section Enrolled: 12
Enrollment data as of: 17-MAY-2022 10:15PM
 
Additional Fees: None
 
Final Exam: GR Course-Dept Schedules Exam
 
Description: Modern methods to extract physical and chemical information from molecular dynamics simulation will be presented, including the determination of reaction coordinates, free energies calculations, and estimation of experimentally measureable observables. The theoretical background and different applications will be discussed. The students will apply the methods on practical examples.