For those who (like me) reads the subject line only
On Wed, Mar 25, 2015 at 1:14 PM, McClean, Jarrod <jmcclean(a)fas.harvard.edu>
wrote:
Hi all,
Don't forget about David Wales talk today at 2pm also! It will be good!
Jarrod
*From:* "Schwickrath, Helen" <schwickrath(a)chemistry.harvard.edu>
*Date:* March 24, 2015 at 2:47:38 PM EDT
*To:* "Schwickrath, Helen" <schwickrath(a)chemistry.harvard.edu>
*Subject:* *[G5] FW: David Wales talk tomorrow*
Wednesday, 25 March
2:00 p.m.
Pfizer Lecture Hall
ITAMP Series
Prof David Wales from the University of Cambridge will be giving a talk at
2pm tomorrow in Pfizer, as part of the ITAMP series. It will probably be
of interest to members of the department, so if you could post this to the
list, it would be appreciated.
I include an abstract:
David Wales:
Energy Landscapes and Prediction of Molecular Properties
------------------------------------------------------------------------------
The potential energy landscape provides a conceptual and computational
framework for investigating structure, dynamics and thermodynamics in
atomic and molecular science. This talk will summarise new approaches for
global optimisation, quantum dynamics, the thermodynamic properties of
systems exhibiting broken ergodicity, and rare event dynamics. Applications
will be presented that range from prediction and analysis of
high-resolution spectra, to conformational changes of biomolecules and
coarse-grained models of mesoscopic structures.
Selected Publications:
D.J. Wales, Curr. Op. Struct. Biol., 20, 3-10 (2010)
D.J. Wales, J. Chem. Phys., 130, 204111 (2009)
B. Strodel and D.J. Wales, Chem. Phys. Lett., 466, 105-115 (2008)
D.J. Wales and T.V. Bogdan, J. Phys. Chem. B, 110, 20765-20776 (2006)
D.J. Wales, Int. Rev. Phys. Chem., 25, 237-282 (2006)
D.J. Wales, "Energy Landscapes", Cambridge University Press, Cambridge,
2003
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--
********************************************
Semion K. Saikin, PhD
Department of Chemistry and Chemical Biology
Harvard University
12 Oxford Street, Cambridge, MA 02138
email: saykin(a)fas.harvard.edu
phone: (619)212-6649
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