Andrew Ferguson

Citation name

Ferguson, A.

Affiliation

University of Chicago

State

IL

Country

USA

Groups/Topicals chaired or co-chaired

Computational Molecular Science and Engineering Forum2024 AIChE Annual Meeting

Sessions chaired or co-chaired

Poster Session: Computational Molecular Science and Engineering Forum2024 AIChE Annual Meeting

Areas chaired or co-chaired

Computational Molecular Science and Engineering Forum

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

Authored

(474a) Predicting Activation Pathway of Integrin Using Generative Adversarial Networks and Targeted Molecular Dynamics Simulations

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

(545c) Generative Model Assisted Sampling of Multiscale Dynamical Systems

Ellis R. Crabtree

Juan Bello-Rivas

Andrew Ferguson

Ioannis G. Kevrekidis

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

(361a) Efficient Data-Driven Discovery of Novel Innate Immunomodulators Using Machine Learning-Guided High Throughput Screening

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

(575g) Invited Talk: Machine Learning-Guided Directed Evolution of Functional Proteins

Andrew Ferguson

2023 AIChE Annual Meeting (ISBN: 978-0-8169-1120-2)

(115i) Data-Driven Backmapping of Coarse-Grained Simulations of Proteins and DNA

Andrew Ferguson

2024 AIChE Annual Meeting

(443c) Data-Driven Protein Design Using Autoregressive Discrete Diffusion Models

Andrew Ferguson

2024 AIChE Annual Meeting

(673a) High-Throughput Virtual Screening and Hybrid Computational/Experimental Active Learning for Novel Hydrogel-Nanoparticle Sensors for Fentanyl Detection

Armin Shayesteh Zadeh

2024 AIChE Annual Meeting

(691h) Understanding the Transition between Nanosheets, Nanotubes, and Nanohelices in Peptoid Assembly System

2024 AIChE Annual Meeting

(394f) Active Learning Cycle to Design Stable Collagen-Mimetic Peptoid Triple Helices

2024 AIChE Annual Meeting

(516d) Assembly of Short Amphiphilic Peptoids into Nanohelices with Controllable Supramolecular Chirality: Insights from Computational Simulation and Theoretical Analysis

2024 AIChE Annual Meeting

(310l) Transfer Learning of Symmetry-Adapted Learned Collective Variables from Classical to Ab Initio Simulations: Enhanced Sampling of Spin Defect Dynamics in Silicon Carbide

2024 AIChE Annual Meeting

(169ao) Permutationally Invariant Network for Enhanced Sampling (PINES): A General Approach to Treating Identical Particles and Constructing Targeted CVs with Machine Learning

2024 AIChE Annual Meeting

(18i) Hybrid Active Learning for Thermally-Responsive Solid-Solid Structural Transitions in Self-Assembled DNA-Functionalized Nanoparticle Crystals

2024 AIChE Annual Meeting

(11e) A Flow-Matching Approach for Generative Backmapping of Biomolecules

Andrew Ferguson

Michael Jones

2024 AIChE Annual Meeting

(709h) Data-Driven Discovery and Optimization of Small Molecules for Immune Modulation Via Machine Learning, Molecular Docking Simulation and Experiment

Oliver Tang

Aaron Esser-Kahn

Andrew Ferguson

2024 AIChE Annual Meeting

(629e) Resolution of the Minimum Free Energy Pathway of Integrin Activation Using Generative Modeling and Finite Temperature String Method

2024 AIChE Annual Meeting

(368m) Data-Driven Discovery of Small Molecules for Immune Modulation Via Machine Learning and High Throughput Screening

Oliver Tang

Andrew Ferguson

Aaron Esser-Kahn

2024 AIChE Annual Meeting

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2023 AIChE Annual Meeting

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Andrew Ferguson

Ferguson, A.

University of Chicago

IL

USA

Groups/Topicals chaired or co-chaired

Sessions chaired or co-chaired

Areas chaired or co-chaired

Authored

Associated proceedings