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, particularly alchemical free energy and/or quantum/machine-learning methods, as well as high-performance computing. Deep familiarity with free energy workflows and Amber is essential. Strong written and
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of small-molecule drugs, nanomaterials/nanoplastics, and other environmental compounds to assess their potential impacts on human health and the environment using machine learning (ML), deep learning
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of small-molecule drugs, nanomaterials/nanoplastics, and other environmental compounds to assess their potential impacts on human health and the environment using machine learning (ML), deep learning
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of small-molecule drugs, nanomaterials/nanoplastics, and other environmental compounds to assess their potential impacts on human health and the environment using machine learning (ML), deep learning
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MITRE . Background in and practical experience with data science, machine learning, and software engineering Background in deep learning, computer vision, LLMs, visual language models, agentic AI, AI