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High-throughput experimentation (HTE) is a critical tool in modern pharmaceutical discovery and development. The ability to perform multiple parallel experiments in miniaturized plate-based formats has revolutionized how chemical reactions are optimized. HTE has been especially enabling for catalytic reactions, where the complexity of factors influencing the outcome makes the HTE approach especially suitable. We detail...

Learn how to use ChemSketch to create reaction mechanisms. This video focuses on adding lone pairs to atoms and drawing curly arrows, including using the arc functionality with different degrees of curvature and the arrow tool. We also cover how to add straight reaction arrows, using the Shift key for precise alignment, and how to...

Leading organizations highlight automation, data quality, and machine learning as efficiency drivers in 2025. Toronto, CANADA (February 06, 2025)—ACD/Labs, an informatics company that develops and commercializes software in support of digitalized R&D, today released its 2025 Structure Elucidation & Verification Report. Distilled from the experience and expertise of hundreds of researchers gathered at the ACD/Labs’...

Navigating the integration of machine learning (ML) and artificial intelligence (AI) in pharmaceutical R&D involves overcoming data management, quality, and expertise challenges to unlock their full potential in drug discovery, reveals Richard Lee, Director, Core Technology and Capabilities, ACD/Labs Published by Scientific Computing World Pharmaceutical companies are under constant pressure to innovate and bring new...