Skip To Content

Driving Efficiency with Spectrus

Efficiency in R&D helps us be more productive, optimize, and innovate. Our recent virtual symposium “Driving Efficiency with Spectrus” brought together scientists from industry-leading organizations (like GSK, AstraZeneca, Genentech, and more) to share strategies that they have implemented, to: Accelerate structure elucidation and verification by NMR and LC/MS Make method development efficient, robust, and sustainable...

To support ongoing digital transformation in life sciences and chemistry-driven organizations, ACD/Labs has introduced Spectrus Conduit—the first out-of-the-box, low-code/no-code application that connects, designs, and manages automated dataflows from analytical instruments and other data sources. Spectrus Conduit creates standardized, harmonized digital twins of the R&D laboratory, improves collaboration, and supports downstream AI/ML applications. ACD/Labs also announced...

Quantitative analysis addresses scientific challenges across various industries such as food, environment, pharmaceutical, and more. It is crucial to ensure the quality of a product by answering “How much?” This question is answered using essential quantitation xC/UV/MS workflows. MS Workbook Suite software offers a fully integrated quantitative workflow where all xC/UV/MS data can be processed and...

What’s New in Luminata This session on what’s new in Luminata version 2023 included topics on: Using the “Resolve Peaks” function to save time when processing chromatograms with the same impurities Performing purge factor calculations in the software How to reduce the time necessary to prepare control strategy summaries

Scientists and IT at AstraZeneca combined their expertise and knowledge to centralize analytical data management in a cloud-based solution and make immediately re-usable data available throughout discovery, development, and for machine learning applications. Read how their automated system—integrated with analytical instruments, their ELN, and archive—is delivering real benefits.

Creating systems for effectively managing analytical chemistry data requires a blend of scientific understanding, technological prowess, and coordinating between teams. That’s why ACD/Labs’ project management team has a critical role to play when deploying analytical chemistry solutions. In this episode, hosts Sarah and Jesse discuss project management with Hans de Bie, who has helped many...

At GSK, Azzedine is responsible for in silico modeling for QbD method development and optimization. In this presentation, Azzedine presents a method development case study detailing decision steps that resulted in a robust and efficient method reached with the assistance of simulation, iterative optimization, and automated method screening using AutoChrom.

Tatiana Didenko of Amgen provides an overview of how Amgen analysts use ACD/Labs software to support high-throughput NMR workflows in compound library generation within Discovery. Tatiana describes the workflow, instrument set up, data management of LC/MS and NMR data, convenient database search parameters for data access, integration with their ELN, and results of an automated...

Sarah’s analytical team at Genentech support medicinal chemists in Discovery and have deployed ACD/Labs technology to manage their LC/MS/MS, 1D NMR, and 2D NMR data. Learn about their analytical data management system and how they’re leveraging data to speed up structure elucidation and verification workflows, reduce experimentation; and make the data available to downstream colleagues...

Get a deeper insight into how computer assisted structure elucidation can help you assign structures to data with confidence. Alexei shares his decades of experience in structure elucidation and presents technology solutions (CASE and DFT) to prevent misassignments as illustrated by natural product structure revisions published in recent years.