Join your peers and community at BIOVIA Live 2024, our annual scientific event, where you can explore the latest advancements, innovative products, network and fun.
Check out these ONE Lab and Formulation sessions at BIOIVIA Live Americas (May 21-23, 2024). 👉Register here: https://bit.ly/44lX32w.
✨Session highlights:
Materials Innovation | ||
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Title | Presenter(s) | Details |
Machine Learning (ML) Applications in Materials Innovation | Nick Reynolds, BIOVIA | Dive into the frontier of materials innovation with real industrial use cases on Machine Learning Applications. Discover how ML algorithms are accelerating material design and unlocking boundless possibilities in diverse industries. |
Artificial Intelligence (AI) Solutions for Organic Chemistry and Materials Design Tasks | Prof. Olexandr Isayev, Carnegie Mellon University | Isayev's Lab at CMU demonstrates deep learning's transformative role in drug discovery and molecular design. Their 'universal' model accelerates computational chemistry significantly, while their ML-guided materials discovery platform challenges norms, promising accelerated innovation with minimal exploration of compositional space. |
| A Quantum Computing Collection for Pipeline Pilot | Irfan Khan, Quantinuum | Quantinuum, the world's largest integrated quantum computing company, introduces alongside BIOVIA, a preview quantum computing collection for Pipeline Pilot. This preview collection enables Pipeline Pilot end-users to access state-of-the-art quantum computing workflows available in InQuanto. Present and future use-cases for material- and pharmaceutical-development will be discussed. |
| Simulations of Complex Electrolytes for Lithium-ion Batteries | Md Jamil Hossain, Brown University | This talk explores advanced electrolytes for high-energy batteries with Li-metal electrodes or in extreme conditions like fast charging and low temperature. We categorize these electrolytes based on solvent-ion interactions into low-concentration (LCE), high-concentration (HCE), or medium concentration (MCE). We discuss computational design and Molecular Dynamics (MD) simulations to understand their complex structures and ion transport. Ionic conductivity is influenced by salt-solvent clusters, and the formation of the solid electrolyte interphase (SEI) is studied by integrating MD and ab initio calculations. |
Closing the Innovation Gap in Consumer Goods | Brian Carboni, Dassault Systèmes | Dassault Systèmes will discuss how consumer behaviors and trends have shifted in recent years as they focus more on self-care and wellness.
Today's challenges require empowering their people with the skills, insights and technology that enables democratized decision-making, and increases in productivity. Brian will touch on how digital solutions can help CPG companies deliver new business value, including:
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