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ACS Macro Letters|May 13, 2022
100th Anniversary of Macromolecular Science Viewpoint: Data-Driven Protein DesignAndrew L Ferguson, Rama Ranganathan
Journal of the American Chemical Society|January 9, 2019
Solid-State NMR and MD Study of the Structure of the Statherin Mutant SNa15 on Mineral SurfacesErika L Buckle, Arushi Prakash, Massimiliano Bonomi, et al.
Soft Matter|October 12, 2019
Inverse design of self-assembling colloidal crystals with omnidirectional photonic bandgapsYutao Ma, Andrew L Ferguson
The Journal of Physical Chemistry. A|April 10, 2023
Girsanov Reweighting Enhanced Sampling Technique (GREST): On-the-Fly Data-Driven Discovery of and Enhanced Sampling in Slow Collective VariablesKirill Shmilovich, Andrew L Ferguson
The Journal of Physical Chemistry. B|July 26, 2016
Mesoscale Simulation of Asphaltene AggregationJiang Wang, Andrew L Ferguson
Journal of Computational Chemistry|October 29, 2018
Molecular enhanced sampling with autoencoders: On-the-fly collective variable discovery and accelerated free energy landscape explorationWei Chen, Andrew L Ferguson
The Journal of Physical Chemistry Letters|December 4, 2023
Umbrella-like Helical Structure of α-Synuclein at the Air-Water Interface Observed with Experimental and Theoretical Sum Frequency Generation SpectroscopyKris Strunge, Tucker Burgin, Thaddeus W Golbek, et al.
Langmuir : the ACS Journal of Surfaces and Colloids|September 14, 2020
Orientation and Conformation of Proteins at the Air-Water Interface Determined from Integrative Molecular Dynamics Simulations and Sum Frequency Generation SpectroscopySarah Alamdari, Steven J Roeters, Thaddeus W Golbek, et al.
Langmuir : the ACS Journal of Surfaces and Colloids|July 28, 2015
Structure Characterization and Properties of Metal-Surfactant Complexes Dispersed in Organic SolventsPablo de la Iglesia, Vance W Jaeger, Yuyin Xi, et al.
Journal of Molecular Biology|December 31, 2011
Key structural features of the actin filament Arp2/3 complex branch junction revealed by molecular simulationJim Pfaendtner, Niels Volkmann, Dorit Hanein, et al.
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