COMPUTATIONAL DRUG DESIGN

Speaker: MALA L. RADHAKRISHNAN , Wellesley College
Date: March 7 2008
Time: 12:30PM to 1:30PM
Location: 32-144
Contact: Shirley A. Entzminger, 3-4347, daisymae@math.mit.edu
Relevant URL: http://www-math. mit.edu/crib
COMPUTATIONAL RESEARCH in BOSTON SEMINAR
Date: FRIDAY, MARCH 7, 2008
Time: 12:30 PM
Location: Building 32, Room 144 (STATA CENTER)
(Pizza and beverages will be provided at 12:15 PM.)
Title:COMPUTATIONAL DRUG DESIGN AND ANALYSIS:A MULTIFACETED APPROACH
Speaker: MALA L. RADHAKRISHNAN (Wellesley College)
ABSTRACT:
Computation is playing an increasingly significant role in the design and analysis of drug molecules to treat disease. Using the HIV-1 protease system and other systems as case studies, I will address the many ways in which computation can specifically tackle system-specific challenges such as drug resistance and drug degradation. Theory, physics-based models, optimization methods, and phenomological larger-scale models can all be integrated into a multi-facted approach to better understand the action of current drugs and to design novel ones for the future.
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Massachusetts Institute of Technology
Cambridge, MA 02139
http://www-math. mit.edu/crib
For information on CRiB, contact:
Alan Edelman: edelman@math.mit.edu
Steven G. Johnson: stevenj@math.mit.edu
Jeremy Kepner: kepner@ll.mit.edu
Patrick Dreher: dreher@mit.edu
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