Learning Deep Convolutional Neural Networks for X-Ray Protein Crystallization Image Analysis
Why this work is in the frame
A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.
Bibliographic record
Abstract
Obtaining a protein's 3D structure is crucial to the understanding of its functions and interactions with other proteins. It is critical to accelerate the protein crystallization process with improved accuracy for understanding cancer and designing drugs. Systematic high-throughput approaches in protein crystallization have been widely applied, generating a large number of protein crystallization-trial images. Therefore, an efficient and effective automatic analysis for these images is a top priority. In this paper, we present a novel system, CrystalNet, for automatically labeling outcomes of protein crystallization-trial images. CrystalNet is a deep convolutional neural network that automatically extracts features from X-ray protein crystallization images for classification. We show that (1) CrystalNet can provide real-time labels for crystallization images effectively, requiring approximately 2 seconds to provide labels for all 1536 images of crystallization microassay on each plate; (2) compared with the state-of-the-art classification systems in crystallization image analysis, our technique demonstrates an improvement of 8% in accuracy, and achieve 90.8% accuracy in classification. As a part of the high-throughput pipeline which generates millions of images a year, CrystalNet can lead to a substantial reduction of labor-intensive screening.
Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.
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 | 0.000 | 0.001 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.001 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.000 |
| Insufficient payload (model declined to judge) | 0.001 | 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 it