Fuzzy Labeled Neural Gas Network for Mass Spectrometry

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Solution Overview

Problem

Conventional clustering and classification algorithms, such as Neural Gas networks, are limited in handling fuzzy labels, which are essential for real-world applications like biological data classification where crisp assignments are difficult or impossible.

Innovation Solution

The development of a Fuzzy Labeled Neural Gas (FLNG) network that incorporates fuzzy class labels into the cost function, allowing for iterative adaptation of weight and class label vectors to minimize misclassification, enabling effective classification of high-dimensional biological data like mass spectrometric data.

Engineering Contradictions & Design Principles

VSEngineering Contradiction Analysis

1Adaptability or versatility

If conventional Neural Gas networks use crisp class labels for training, then the classification algorithm achieves clear decision boundaries, but it cannot handle fuzzy labels essential for biological data where crisp assignments are difficult or impossible

Engineering Contradiction:
Improveability to handle fuzzy labelsVSAvoidcomplexity of cost function
Core Design Contradiction:
Adaptability or versatilityVSDevice complexity

Solution Approach 1:

The patent changes the parameter representation from crisp binary labels to fuzzy continuous values in the range [0,1]. The cost function is modified to incorporate these fuzzy labels through a transformation that converts them into weighted contributions, allowing the network to handle uncertain classifications while maintaining the原有 neural gas algorithm structure.

Inventive Principle:
Principle #35Parameter changes

2Reliability

If the cost function is extended to incorporate fuzzy class labels, then the network can classify biological data with uncertain labels, but the computational complexity increases

Engineering Contradiction:
Improveclassification accuracy for biological dataVSAvoidcomputational resources
Core Design Contradiction:
ReliabilityVSPower

Solution Approach 1:

The patent performs preliminary transformation of fuzzy class labels into a format suitable for the cost function before the main training process. By pre-processing the label information and establishing the transformed cost function structure in advance, the network reduces computational overhead during iterative training while maintaining the ability to handle fuzzy biological data effectively.

Inventive Principle:
Principle #10Preliminary action

3Manufacturing precision

If prototypes are shifted based on fuzzy label differences, then misclassification is reduced, but the training process requires more iterations to converge

Engineering Contradiction:
Improveclassification precisionVSAvoidtraining time
Core Design Contradiction:
Manufacturing precisionVSLoss of time

Solution Approach 1:

The patent implements a feedback mechanism where the transformed cost function continuously provides gradient information about misclassification errors. This feedback guides the prototype adaptation process by indicating the direction and magnitude of adjustments needed, enabling the network to converge to accurate classifications more efficiently despite the complexity of handling fuzzy labels.

Inventive Principle:
Principle #23Feedback

Data Source

PatentUS7991223B2Method for training of supervised prototype neural gas networks and their use in mass spectrometry
Publication Date: 2011.08.02 BRUKER DALTONIK GMBH & CO KG
  • US7991223B2 patent drawing
  • US7991223B2 patent drawing
  • US7991223B2 patent drawing

AI summary

A Neural Gas network used for pattern recognition, sequence and image processing is extended to a supervised classifier with labeled prototypes by extending a cost function of the Neural Gas network with additive terms, each of which increases with a difference between elements of the class labels of a prototype and a training data point and decreases with their distance. The extended cost function is then iteratively minimized by adapting weight vectors of the prototypes. The trained network can then be used to classify mass spectrometric data, especially mass spectrometric data derived from biological samples.