Thursday, March 8, 2018
11:15AM - 11:51AM
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S20.00001: Computing free-energy landscapes of co-operative structure changes in soft, biological matter
Invited Speaker:
Marcus Mueller
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Thursday, March 8, 2018
11:51AM - 12:03PM
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S20.00002: From cellulose and lignin to kerogen: molecular simulations of a geological process
Roland Pellenq, Lea Atmani, Christophe Bichara, Henri Van Damme, Adri Van Duin, Franz Ulm, Jean-Marc Leyssale
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Thursday, March 8, 2018
12:03PM - 12:15PM
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S20.00003: RNA Structure Prediction Including Pseudoknots through Direct Enumeration of States
Ofer Kimchi, Tristan Cragnolini, Michael Brenner, Lucy Colwell
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Thursday, March 8, 2018
12:15PM - 12:27PM
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S20.00004: Two Disease-Causing SNAP-25B Mutations Selectively Impair SNARE C-terminal Assembly
Aleksander Rebane, Bigeng Wang, Lu Ma, Hong Qu, Jeff Coleman, Shyam Krishnakumar, James Rothman, Yongli Zhang
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Thursday, March 8, 2018
12:27PM - 12:39PM
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S20.00005: Universal and Efficient Entropy Estimation Using a Compression Algorithm
Ram Avinery, Micha Kornreich, Roy Beck
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Thursday, March 8, 2018
12:39PM - 12:51PM
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S20.00006: Computational high-throughput screening of drug-membrane thermodynamics
Roberto Menichetti, Kiran H. Kanekal, Kurt Kremer, Tristan Bereau
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Thursday, March 8, 2018
12:51PM - 1:03PM
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S20.00007: Insights into Protegrin Antimicrobial Peptides Membrane Translocation by Multistep Molecular Dynamics Simulations
Pin-Kuang Lai, Yiannis Kaznessis
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Thursday, March 8, 2018
1:03PM - 1:15PM
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S20.00008: Energy landscapes from single-particle imaging of biological processes in and out of equilibrium
Jeremy Copperman, Ali Dashti, Ghoncheh Mashayekhi, Ahmad Hosseinizadeh, Abbas Ourmazd, Peter Schwander
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Thursday, March 8, 2018
1:15PM - 1:27PM
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S20.00009: From KB to KB: observing entropy dynamics of complex systems using lossless compression algorithms
Ram Avinery, Micha Kornreich, Roy Beck
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Thursday, March 8, 2018
1:27PM - 1:39PM
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S20.00010: The kinetics of solution-phase Ag nanowire growth mediated by PVP: A theoretical perspective
Xin Qi, Kristen Fichthorn
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Thursday, March 8, 2018
1:39PM - 1:51PM
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S20.00011: Toward realistic dynamical simulations of advanced materials, including ultrafast phase transitions
Roland Allen, Jian Weng, Ross Tagaras
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Thursday, March 8, 2018
1:51PM - 2:03PM
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S20.00012: An evaluation of the accuracy of dynamic transition matrix calculations of Ising spin systems
David Yevick
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