Domain-specific languages as a tool for knowledge representation in polymer chemistryNathaniel Park2023ACS 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
Combining molecular simulation and AI for antibody design against cancer immunotherapy targetsJeff Weber2023ACS Fall 2023
AI powered, automated discovery of polymer membranes for carbon captureRonaldo GiroHsianghan Hsuet al.2023npj Computational Materials
Towards Coherent Image Inpainting Using Denoising Diffusion Implicit ModelsGuanhua ZhangJiabao Jiet al.2023ICML 2023