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Short Talks
September 30th, 2014, Helen Diller HD 160, UCSF Cancer Center, 1450 3rd St, San Francisco, CA 94158, San Francisco
(The Symposium will be held at a different location - The Mark Hopkins Hotel, 999 California St., San Francisco)
Tuesday, September 30th - 12-5 pm | |||
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12:00-12:10 | Moderator | Andrej Sali | University of California, San Francisco, USA |
12:10-12:25 | QM/MM investigation of substrate-assisted catalysis | Hong Guo | University of Tennessee |
12:25-12:40 | An overview of simulations on the plexin and Eph transmembrane receptor systems | Matthias Buck | Case Western Reserve |
12:40-12:55 | How insulin binds: from structure of a model hormone-receptor complex to next-generation analog design | Michael Weiss | Case Western Reserve |
12:55-1:10 | Substrate-Assisted Glycosylation Reaction Follows a Highly Concerted Pathway that Leads to a Low-Barrier-Hydrogen-Bond Transition State | Wei Yang | Florida State University |
1:10-1:25 | Binding mechanism of intrinsically disordered proteins from molecular simulation | Robert Best | NIDDK, National Institutes of Health |
1:25-1:40 | On the Question of Atoms and Bonds in Molecules | Peter Langhoff | UC San Diego |
1:40-1:55 | Toward understanding the ATP hydrolysis mechanism in ABC-transporters: insights from multiscale simulations | Jingzhi Pu | Indiana University-Purdue University |
1:55-2:10 | Ab initio dynamics of proteins by using FMO | Yuri Alexeev | Argonne National Laboratory |
2:10-2:25 | Reactions at water surfaces: aerosols, vesicles and bubbles | Veronica Vaida | University of Colorado, Boulder |
2:25-2:55 | BREAK | ||
Moderator | Matt Jacobson | University of California, San Francisco, USA | |
2:55-3:10 | Simulating biomolecular processes at multiple scales | Wonmuk Hwang | Texas A&M University |
3:10-3:25 | Multi-scale QM/MM model for the study of catalytic mechanism of protein tyrosine kinase | Kwangho Nam | Umea University |
3:25-3:40 | Multiscale Motions in Nucleic Acids | Ioan Andricioaei | UC Irvine |
3:40-3:55 | The SCOPe database (http://scop.berkeley.edu) | John-Marc Chandonia | Berkeley National Lab |
3:55-4:10 | Uncovering the complex pathway of helix formation | Krzysztof Kuczera | University of Kansas |
4:10-4:25 | Protein Electrodynamics and Terahertz Medicine | Ogan Gurel | Samsung Advanced Institute of Technology |
4:25-4:40 | Ras GTPase: Effects of oncogenic mutants | Carla Mattos | Northeastern University |