个人简介

Scholar in Residence Institut des Hautes Etudies Scientifiques Paris, 2008-2010 Fellow American Association for the Advancement of Science , 2007 Fellow American Physical Society , 2006

研究领域

Biochemistry/Physical

The work in my group focuses on understanding the chemistry and physics of complex chemical reactions. The overall goal of the work in my group is to produce methods and applications that explain phenomena that we cannot directly interrogate by experiment. In particular, much of our effort is focused on a wide range of biological systems. The work centers on both the development of basic new theoretical methods and application of the theoretical approaches to real systems. The research continues to result in basic additions to our understanding of the chemistry and physics of life processes. A few specific examples follow.

近期论文

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Zoi, I. ; Motley, M. ; Antoniou, D. ; Schramm, V. L. ; Schwartz, S. D. Enzyme Homologues Have Distinct Reaction Paths Through Their Transition States. J. Phys. Chem. B 2015, 119, 3662-3668. der Poorten, V. O. ; Zoi, I. ; Schwartz, S. D. ; Cai, M. ; Hruby, V. ; Ballet, S. Azepinone-Containing Tetrapeptide Analogues Of Melanotropin Lead To Selective Hmc4R Agonists And Hmc5R Antagonist. Medicinal Chemistry Letters 2015, 6, 192-197. Masterson, J. ; Schwartz, S. D. Evolution Alters The Enzymatic Reaction Coordinate Of Dihydrofolate Reductase. J. Phys. Chem. B 2015, 119, 989-996. Masterson, J. ; Schwartz, S. D. The Enzymatic Reaction Catalyzed By Lactate Dehydrogenase Exhibits One Dominant Reaction Path. Chem. Phys. 2014, 442, 132-136. Masterson, J. ; Schwartz, S. D. Changes In Protein Architecture And Subpsec Protein Dynamics Impact The Reaction Catalyzed By Ldh. J. Phys. Chem. A 2013, 117, 7107. Motley, M. ; Schramm, V. ; Schwartz, S. D. Conformational Freedom In Tight Binding Enzymatic Transition State Analogues. J. Phys. Chem. B 2013, 117, 9591. Schwartz, S. D. Protein Dynamics And The Enzymatic Reaction Coordinate. Top. Curr. Chem. 2013, 337, 189. Dametto, M. ; Antoniou, D. ; Schwartz, S. D. Barrier Crossing In Dhfr Does Not Involve A Rate-Promoting Vibration. Mol. Phys. 2012, 110, 531. Antoniou, D. ; Ge, X. ; Schramm, V. ; Schwartz, S. D. Mass Modulation Of Protein Dynamics Associated With Barrier Crossing In Pnp. J. Phys. Chem. Lett. 2012, 3, 3538. Manning, E. ; Tardiff, J. ; Schwartz, S. D. Molecular Effects Of Familial Hypertrophic Cardiopathy-Related Mutations In The Tnt1 Domain Of Ctnt. J. Mol. Biol. 2012, 421, 54. Manning, E. ; Tardiff, J. ; Schwartz, S. D. A Model Of Calcium Activation Of The Cardiac Thin Filament. Biochemistry 2011, 50, 7405. Gelman, D. ; Schwartz, S. D. Finite Temperature Application Of The Corrected Propagator Method To Reactive Dynamics In A Condensed-Phase Environment. J. Chem. Phys. 2011, 134, 034109. Antoniou, D. ; Schwartz, S. D. Protein Dynamics And Enzymatic Chemical Barrier Passage. J. Phys. Chem. B 2011, 115, 15147. Antoniou, D. ; Schwartz, S. D. Reply To Comment. J. Phys. Chem. B 2011, 115, 12674. Davarifar, A. ; Antoniou, D. ; Schwartz, S. D. The Promoting Vibration In Ldh Is A Preferred Vibrational Channel. J. Phys. Chem. B 2011, 115, 15439. Antoniou, D. ; Schwartz, S. D. Towards Identification Of The Reaction Coordinate Directly From The Transition State Ensemble Using The Kernel Pca Method. J. Phys. Chem. B 2011, 115, 2465. Gelman, D. ; Schwartz, S. D. Dissipative Dynamics With The Corrected Propagator Method. Chem. Phys. 2010, 370, 62. Quaytman, S. ; Pineda, E. ; Schwartz, S. D. On The Origin Of The Chemical Barrier And Tunneling In Enzymes. J. Phys. Org. Chem. 2010, 23, 690. Pineda, E. ; Antoniou, D. ; Schwartz, S. D. Slow Conformational Motions That Favor Sub-Ps Motions Important For Catalysis. J. Phys. Chem. B 2010, 114, 15985.