Unsupervised Fault Detection of Pharmaceutical Processes Using Long Short-Term Memory Autoencoders
Bibliographic record
Abstract
Unsupervised multilayer long short-term memory autoencoder (LSTM-AE) models are proposed for monitoring nonlinear batch processes. The methodology is demonstrated for a simulation-based study of an industrial-scale penicillin process and for an industrial vaccine manufacturing process, using production data. The LSTM-AE model was trained with two different loss functions: minimizing mean square error (MSE) between the input and reconstructed data and maximizing the average fault detection rate ( FDR ¯ ) in the training data set. Two algorithms are also proposed for obtaining contribution plots for the diagnosis of faults. For the industrial case study, where the faults are not known a priori, the contribution plots are found to be a valuable tool for identifying possible sources of faults. Furthermore, a semisupervised procedure has been proposed to select the normal process region for training the model. Two metrics are also presented to evaluate the performance of the proposed methodology: one for the simulator case study in which fault knowledge is available and one for the industrial case study in which fault knowledge is not available a priori. The proposed unsupervised algorithms exhibit a clear improvement in accuracy over linear methods or nonlinear techniques that do not explicitly account for dynamic behavior.
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How this classification was reachedexpand
Full frame distilled prediction
Teacher imitationNot calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.
Codex and Gemma teacher scores by category
| Category | Codex | Gemma |
|---|---|---|
| Metaresearch | 0.001 | 0.001 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.002 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.001 |
| Insufficient payload (model declined to judge) | 0.000 | 0.000 |
Machine scores (provisional)
The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.
Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.
score_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from itClassification
machine, unvalidatedMachine predicted; a candidate call from one teacher head, not a consensus.
How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".