Raman Spectra Water-Band Normalization for Bioprocess Prediction

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Solution Overview

Problem

Raman spectroscopy in bioprocesses faces challenges in predicting medium parameters due to variations in optical hardware, such as different light throughputs and optical interfaces, which are not adequately corrected, leading to increased prediction errors, especially in large-scale single-use bioreactors where calibration with standard solutions is impractical.

Innovation Solution

Normalizing Raman spectra using the intensity or integral of a characteristic water band, which is directly proportional to light throughput, allows for the reduction or elimination of variations caused by different measuring assemblies, enabling more precise predictions and model transfer between different process scalings.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Adaptability or versatility

If Raman spectroscopy is used in large-scale single-use bioreactors, then the applicability to commercial production is improved, but the measurement precision deteriorates due to ambient light interference and inability to shield with aluminum foil

Engineering Contradiction:
Improveapplicability to large-scale bioreactorsVSAvoidquality of Raman spectra
Core Design Contradiction:
Adaptability or versatilityVSMeasurement precision

Solution Approach 1:

The patent changes the parameter of light throughput by using the water band intensity as a reference to normalize spectra. This allows compensation for variations in ambient light conditions and optical hardware differences, maintaining measurement precision across different bioreactor scales without requiring aluminum foil shielding

Inventive Principle:
Principle #35Parameter changes

Solution Approach 2:

The water band serves as an intermediary reference signal that mediates between the variable ambient light conditions and the Raman spectral measurements. By normalizing to this stable internal reference, the system compensates for external interference and hardware variability

Inventive Principle:
Principle #24Intermediary (Mediator)

2Reliability

If classical data pre-processing (SNVT, derivatives) is applied to Raman spectra, then the influence of probe differences is reduced, but the signal-to-noise ratio deteriorates

Engineering Contradiction:
Improvecorrection of probe differencesVSAvoidsignal-to-noise ratio
Core Design Contradiction:
ReliabilityVSMeasurement precision

Solution Approach 1:

Instead of applying classical pre-processing transformations that degrade the signal, the patent changes the approach by using intensity normalization based on the water band. This preserves the original spectral information and signal-to-noise ratio while still correcting for probe differences in light throughput

Inventive Principle:
Principle #35Parameter changes

3Measurement precision

If calibration with standard solutions is performed, then the prediction accuracy is improved, but the device complexity and process time increase due to requiring separate calibration steps

Engineering Contradiction:
Improveprediction accuracyVSAvoidcalibration process complexity
Core Design Contradiction:
Measurement precisionVSDevice complexity

Solution Approach 1:

The system performs self-calibration using the water band present in the actual cell culture medium itself, without requiring separate standard solutions or external calibration procedures. The medium provides its own reference signal for normalization

Inventive Principle:
Principle #25Self-service

Solution Approach 2:

The water band normalization is performed as a preliminary step that prepares the spectral data for accurate prediction. By normalizing to the water band before building or applying prediction models, the system ensures consistent results across different probes and conditions

Inventive Principle:
Principle #10Preliminary action

4Ease of operation

If different optical probes and fiber connections are used, then the ease of operation is improved, but the manufacturing precision deteriorates due to variability in light throughput

Engineering Contradiction:
Improveflexibility in probe selectionVSAvoidconsistency of spectral intensity
Core Design Contradiction:
Ease of operationVSManufacturing precision

Solution Approach 1:

The patent addresses the variability in light throughput by changing the intensity parameter through water band normalization. This allows different probes and fiber connections to be used interchangeably while maintaining consistent spectral interpretations across all hardware variations

Inventive Principle:
Principle #35Parameter changes

Applied Scientific Principles

This section explains which scientific principles are used to turn an abstract innovation direction into a practical engineering solution.

Function Achieved in This Case

This approach significantly improves the accuracy of parameter predictions in bioprocesses by leveling the sensitivities of different measuring assemblies and reducing noise, facilitating cross-scale application and robust model building, even when using new bioreactors with varying spectroscopy ports.

Implementation Method 1

Raman spectroscopy is increasingly used to control bioprocesses. Devices used in the bioprocess for acquiring Raman spectra usually include a spectrometer and an optical probe

Methodology Applied
Scientific EffectRaman scattering: Scattering

Implementation Method 2

normalizing the first series of preparatory Raman spectra based on a characteristic band of water from at least one Raman spectrum acquired with the first measuring assembly

Methodology Applied
Scientific EffectRaman scattering of water: Scattering

Data Source

PatentEP3822717A1Method and device assembly for predicting a parameter in a bioprocess based on raman spectroscopy and method and device assembly for controlling a bioprocess
Publication Date: 2021.05.19 SARTORIUS STEDIM DATA ANALYTICS AB
  • EP3822717A1 patent drawingFigure 1
  • EP3822717A1 patent drawingFigure 2
  • EP3822717A1 patent drawingFigure 3

AI summary

A method of predicting a parameter of a medium to be observed in a bioprocess based on Raman spectroscopy comprises the steps of: acquiring a first series of preparatory Raman spectra of an aqueous medium using a first measuring assembly; normalizing the first series of preparatory Raman spectra based on a characteristic band of water from at least one Raman spectrum acquired with the first measuring assembly; building a multivariate model for the parameter based on the normalized preparatory Raman spectra; acquiring predictive Raman spectra of the medium to be observed during the bioprocess with another measuring assembly; normalizing the predictive Raman spectra based on a characteristic band of water from at least one Raman spectrum acquired with the other measuring assembly; and applying the built model to the predictive Raman spectra for predicting the parameter. A device assembly for predicting a parameter of a medium to be observed in a bioprocess is adapted to carry out this method.