Domain-specific languages as a tool for knowledge representation in polymer chemistryNathaniel Park2023ACS Fall 2023
Combining molecular simulation and AI for antibody design against cancer immunotherapy targetsJeff Weber2023ACS Fall 2023
Graph-based 3D Generative Small-Molecule Modeling Targeting for Multi Proteins with Enhanced Binding CompatibilitySeung Gu KangJeff Weberet al.2023ACS Fall 2023
Utilizing domain-specific languages as a tools for enabling AI-guided materials designNathaniel Park2023ACS Fall 2023
Characterization of small molecule latent spaces derived from a variety of generative molecule creation approachesWendy Cornell2023ACS Fall 2023
AI powered, automated discovery of polymer membranes for carbon captureRonaldo GiroHsianghan Hsuet al.2023npj Computational Materials