MS-Mo-E-49
Rare Events in Complex Physical Systems - Part II of IV
For Part I, see MS-Mo-D-49
For Part III, see MS-Tu-D-49
For Part IV, see MS-Tu-E-49

Date: August 10
Time: 16:00--18:00
Room: 107

(Note: Click title to show the abstract.)

Organizer:
Cameron, Maria (Univ. of Maryland)
Li, Tiejun (Peking Univ.)
Lu, Jianfeng (Duke Univ.)
Weare, Jonathan (Univ. of Chicago)
Zhou, Xiang (City Univ. of Hong Kong)

Abstract: Many problems arising from chemistry, physics and materials science involve rare but significant exit events and/or transition events between stable states. The transitions happen on a time scale much longer than the intrinsic time scale of the dynamical system. Examples of such events are conformational changes of biomolecules, chemical reactions, etc. The purpose of this minisymposium is to bring together experts working in theory, numerical algorithms and application issues, such as analysis of models for metastable systems, free energy calculation, importance sampling, accelerated dynamics, and sampling of transition pathways.


MS-Mo-E-49-1
16:00--16:30
Enhanced sampling simulations of chemical reactions in solution
Gao, Yiqin (Peking Univ.)


MS-Mo-E-49-2
16:30--17:00
Efficient numerical methods for Brownian, Langevin and other stochastic differential equations for sampling a probability distribution, with applications in multiscale modelling and machine learning
Leimkuhler, Benedict (Univ. of Edinburgh)


MS-Mo-E-49-3
17:00--17:30
Investigation Conformational Changes of Biological Macromolecules Using Kinetic Network Models
Huang, Xiuhui (The Hong Kong Univ. of Sci. & Tech.)


MS-Mo-E-49-4
17:30--18:00
Shrinking Dimer Dynamics and its Variants for Reliable Transition State Search
Zhang, Lei (Peking Univ.)
Du, Qiang (Columbia Univ.)

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Footnote:
Code: Type-Date-Time-Room No.
Type : IL=Invited Lecture, SL=Special Lectures, MS=Minisymposia, IM=Industrial Minisymposia, CP=Contributed Papers, PP=Posters
Date: Mo=Monday, Tu=Tuesday, We=Wednesday, Th=Thursday, Fr=Friday
Time : A=8:30-9:30, B=10:00-11:00, C=11:10-12:10, BC=10:00-12:10, D=13:30-15:30, E=16:00-18:00, F=19:00-20:00, G=12:10-13:30, H=15:30-16:00
Room No.: TBA