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Chrom Reaction Optimization

Automated Solution for Chemical Reaction Optimization
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About Chrom Reaction Optimization

Chrom Reaction Optimization (Chrom RO) is an automated software tool for processing, analyzing, and reporting large-scale chromatography (LC/GC‑MS) datasets. It tracks defined chemical components across multiple reaction samples, quantifies them, and presents results in structured, user-friendly formats, enabling chemists to efficiently compare outcomes and make informed decisions on optimal conditions.

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High-Throughput
with Speed
Process and quantify thousands of reactions automatically within hours instead of days
Customizable & Reusable Setup
Create, save, and reuse analysis methods, including input, processing, reporting, and archiving configurations
Flexibility & Integration
Use Chrom RO alongside your preferred workflow applications and LC/GC–MS instruments, integrating seamlessly with your lab setup
Graphical Clarity
Visualize results using color-coded charts and interactive reports for rapid comparison and confident decision-making

Features

Customizable and Reusable Analysis Methods

Chrom RO offers fully customizable analysis, supporting varied chromatogram types, including UV/PDA, MS, other traces, and more. Users can define components (to track or ignore), matching criteria (by mass information or retention time), quantification rules (easily performed through data gathered from Chrom Cal - additional license needed), and thresholds for quality control. Analysis methods can be saved and shared by experts, then reused to enable efficient, robust workflows.

Smart Data Quality Control

Experts can define analysis criteria and configure colored flags to alert users of issues like missing peaks, overlapping signals, or retention time deviations, enabling quick review, correction, and consistent, high-quality results across all samples.

Graphical Summaries and Global Reports

Chrom RO streamlines decision-making by generating interactive graphical and global reports in multiple formats (Mnova, PDF, CSV, HTML). Reaction components, yields, and concentrations are visually summarized, enabling rapid comparison and identification of optimal conditions.

Manual Review and Correction Workflow

Chrom RO provides an interactive viewer to inspect and correct peak assignments, allowing users to re-run analyses and maintain full control, ensuring automation enhances efficiency without compromising data quality or accuracy.

Benefits

Time Savings: Analysis automation enables chemists to focus on chemistry instead of tedious data processing.

Increased Productivity: Streamlined processes accelerate project progress, enabling faster time-to-market.

Improved Data Quality: Automation reduces human errors and ensures consistent, high-quality results.

Cost Savings: Reduced labor and increased efficiency lower operational costs and resource requirements.

Videos

Automate, Simplify, and Speed Up Your Process with Chrom RO

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Webinars

Discovery of small molecules that target RNA. NMR is the method of choice.

Enhancing High-Throughput LCMS Workflows from Mass Peak Tracking to AI/ML Integration with Chrom RO

Explore how advanced solutions streamline LCMS workflows in high-throughput experimentation (HTE), eliminate inefficiencies, and enable seamless AI/ML integration through automated data processing, centralized management, and standardized outputs.
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Accelerating high troughput

Accelerating High-Throughput Experimentation Workflows Using Automated Data Processing

Join us for an engaging webinar on high throughput analytical data management featuring Holly Douglas, Senior Research Scientist from AstraZeneca. Discover how integrating the Reaction Optimization software solution is revolutionizing drug discovery by streamlining workflows and enhancing data quality.
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Articles

Enhancing High-Throughput LCMS Workflows

Is Chrom Reaction Optimization for me?

Do you work in reaction scale up? Are you optimizing conditions, comparing dozens of reaction variables? If so, Chrom RO is built for you.
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Reactions Data Automation

Reactions, Reactions, Reactions – Data Automation to the Rescue

Reaction optimization is crucial for achieving efficient syntheses of final products or intermediates. While different approaches can reduce the number of trial reactions, effectively handling and analyzing LCMS data to quantify components remains a significant challenge.
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Support

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