Automated synthesis with SYNTHIA retrosynthesis software

9 Jul 2024

SYNTHIA™ retrosynthesis software aids chemists in designing synthetic routes, offering ranked potential routes to target molecules, while Synple's cartridge-based synthesis technology automates chemical reactions commonly used in discovery chemistry. Merck KGaA, Darmstadt, Germany, discusses the integration of SYNTHIA retrosynthesis software with Synple Automated Synthesizer to streamline synthetic chemistry processes. It highlights the advancements in technology and automation, including robotic systems, machine learning algorithms, and virtual screening methods, which accelerate molecule discovery and synthesis while minimizing errors. There is also case study comparing different search configurations and demonstrates the quick and efficient synthesis of target molecules using both manual and automated approaches, showcasing the potential of this integrated workflow to accelerate the drug discovery process.

Links

Tags

Combinatorial ChemistryCombinatorial chemistry, also known as combichem, is a technique used in drug discovery to create libraries of structurally related compounds. A library is generated by synthesis with a chemical reactor system or by computer-based modeling of compound combinations. When undertaking combinatorial chemistry consider reagents, buffers, resins and standards.Sample ManagementSample management systems include sample storage devices such as freezers and plate storers, sample environment enclosures and sample organization, retrieval and sorter systems. Useful system features include high-throughput, automation, robotic arms, automated liquid handling and associated database systems. Accessories in sample management include barcode scanners, heat sealers and tubes.Discovery SoftwareComputational techniques used in both the chemistry and biology aspects of drug discovery, for data acquisition, processing and storage. Software is used for analysis of pathways, target identification, genomics, proteomics, modelling, lead identification, compound analysis and drug modelling among many others. Artificial Intelligence / Machine LearningArtificial intelligence (AI) and machine learning (ML) are transformative technologies used to analyze complex data, identify patterns, and make data-driven predictions across diverse scientific fields. Automate the analysis of large or complex data sets using AI algorithms and leverage machine learning models to improve diagnostics, accelerate drug discovery, and refine experimental design. Discover the best AI/ML software, platforms, and analytical tools in our peer-reviewed product directory: compare features, read customer reviews, and request pricing directly from manufacturers.Synthetic ChemistryBiotechnologyBiotechnology is the use of biological processes, organisms, or systems in the production of products and services. It spans a wide range of applications, including healthcare, agriculture, and environmental management. Browse our peer-reviewed product directory to find the best biotechnology tools, compare products, check reviews, and get pricing directly from manufacturers.
Automated synthesis with SYNTHIA retrosynthesis software