Alex Morehead

Alex Morehead

Hopper Postdoctoral Fellow

National Energy Research Scientific Computing Center (NERSC)

Science Engagement & Workflows Dept.

Data & AI Services Group

Alex Morehead is a Hopper Postdoctoral Fellow in the National Energy Research Scientific Computing Center (NERSC) at Lawrence Berkeley National Laboratory. Alex is broadly interested in machine learning, deep learning, computational biology, and generative modeling. Prior to joining Berkeley Lab, Alex earned a Ph.D. degree from the University of Missouri in the Department of Electrical Engineering and Computer Science.

Education

PhD - University of Missouri, United States

BS - Missouri Western State University, United States

Recent Publications

Assessing the potential of deep learning for protein–ligand docking

Authors: Morehead, A; Giri, N; Liu, J; Neupane, P; Cheng, J

December 2025, Nature Machine Intelligence


Protein‐Ligand Structure and Affinity Prediction in CASP16 Using a Geometric Deep Learning Ensemble and Flow Matching

Authors: Morehead, A; Liu, J; Neupane, P; Giri, N; Cheng, J

April 2025, Proteins: Structure, Function and Bioinformatics


Geometry-complete diffusion for 3D molecule generation and optimization.

Authors: Morehead, A; Cheng, J

July 2024, Communications Chemistry


Protein structure accuracy estimation using geometry-complete perceptron networks.

Authors: Morehead, A; Liu, J; Cheng, J

March 2024, Protein Science


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