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Logan Ward

MOFA: Discovering Materials for Carbon Capture with a GenAI- and Simulation-Based Workflow

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Jan 18, 2025
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Employing Artificial Intelligence to Steer Exascale Workflows with Colmena

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Aug 26, 2024
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Trillion Parameter AI Serving Infrastructure for Scientific Discovery: A Survey and Vision

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Feb 05, 2024
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Accelerating Electronic Stopping Power Predictions by 10 Million Times with a Combination of Time-Dependent Density Functional Theory and Machine Learning

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Nov 01, 2023
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DeepSpeed4Science Initiative: Enabling Large-Scale Scientific Discovery through Sophisticated AI System Technologies

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Oct 11, 2023
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14 Examples of How LLMs Can Transform Materials Science and Chemistry: A Reflection on a Large Language Model Hackathon

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Jun 13, 2023
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Cloud Services Enable Efficient AI-Guided Simulation Workflows across Heterogeneous Resources

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Mar 15, 2023
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Colmena: Scalable Machine-Learning-Based Steering of Ensemble Simulations for High Performance Computing

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Oct 06, 2021
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Evening the Score: Targeting SARS-CoV-2 Protease Inhibition in Graph Generative Models for Therapeutic Candidates

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May 07, 2021
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Benchmarking Deep Graph Generative Models for Optimizing New Drug Molecules for COVID-19

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Feb 09, 2021
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