2021 Annual Meeting

Session: Thermodynamics at the Nanoscale

Chair

Mahynski, N., National Institute of Standards & Technology

Co-Chairs

Mani, S., The University of Chicago
Kapoor, U., Oklahoma State University

Presentations

08:00 AM

(593a) Free Energy Simulations Along Entropic Pathways: Sampling Phase Transitions at the Nanoscale
Desgranges, C., Delhommelle, J.

08:14 AM

(593b) Probing Metal Nanocrystal Shapes and Shape Transformations Using Replica Exchange Molecular Dynamics Simulations
Yan, T., Fichthorn, K.

08:54 AM

(593d) Free Energy Calculation on Human Beta Defensin Translocation through Bacterial Lipid Membranes
Brewer, A., Zhang, L.

09:08 AM

(593e) Phase Transition and Criticality of Methane Confined in Nanopores
Yang, H., Qiu, X., Adidharma, H., Dejam, M., Tan, S. P.

09:22 AM

(593f) [Invited Talk] Re-Entrant Dynamics and Anomalous Fluctuations in Strongly Confined Liquids
Palmer, J.

09:48 AM

(593g) Free Energy Landscape of Alkanes Confined within Supramolecular Complexes
Ashbaugh, H., Alagbe, B., Gibb, B. C.

10:02 AM

(593h) Hydration Free Energies of Linear Alkanes Studied Via Molecular Simulations
Sharma, S., Faeli Qadikolae, A.

10:16 AM

(593i) Molecular Dynamics Simulations of Nanostructures Formed By Hydrophobins and Oil in Seawater
Hung, F., Vodopivec, A., Chen, Y., Russo, P.