2023 AIChE Annual Meeting

Session: Computational Studies of Self-Assembly

Chair

Sharma, S., Ohio University

Co-Chair

Presentations

08:00 AM

(272a) Computational and Experimental Studies on the Self-Assembly of Novel Cancer Drug Peptide-Based Carrier Systems
Tamamis, P., Vlachou, A., Kumar, V. B., Gazit, E.

08:15 AM

(272b) Polymeric Aqueous Two Phase System with an Immobilized Phase By Cross-Linking
Zeiner, T., Fischlschweiger, M.

08:30 AM

(272c) Simulations Investigating the Structure and Dynamics of Nanomaterial-Amyloid Interactions
Brown, G., Tamamis, P., Pham, K. V.

08:45 AM

(272d) Investigating the Role of Ceramide Conformation on the Multilayer Structure of Lipids in the Stratum Corneum Via Multiscale Simulation
Shamaprasad, P., Frame, C., Nadaban, A., Iacovella, C. R., Bunge, A., Bouwstra, J., McCabe, C.

09:00 AM

(272e) Simulation of Corona Formation on Single-Walled Carbon Nanotubes: Ionic Vs. Anionic Surfactants
Hinkle, K., Winget, A.

09:15 AM

(272f) Computational Studies of the Metastability of Colloidal Squares with Offset Dipoles at High Densities
Dorsey, M., Velev, O. D., Hall, C.

09:30 AM

(272g) Combining Coarse-Grained Modeling and Enhanced Sampling to Understand the Self-Assembly of Porous Crystals
Ardila, K., Gomez Gualdron, D., Pak, A. J.

09:45 AM

(272h) Anatomy of a Complex Crystallization Pathway
Zhao, C., Fijan, D., Glotzer, S. C.

10:00 AM

(272i) Mechanisms of Spontaneous Solid–Solid Phase Transitions between Different Crystal Structures
Dshemuchadse, J., Pan, H.

10:15 AM

(272j) Surrogate Modeling of the Relative Entropy for Inverse Design
Petix, C., Kieslich, C., Fakhraei, M., Howard, M.