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MechLLM

This is a synthetic dataset generated for electron movement extraction.

Data Description

The synthetic folder contains the synthetic reaction image from the pistachio dataset with curved arrow programatically drawn on the image.

The number folder contains the related number labels of the atoms.

the json file for corresponding image folders contains the start and end atom of electron movements, and the number of electron movements.


.
├── number/
│   ├── generated_images_debug/
│   ├── generated_images_debug_multiline/
│   ├── generated_images_debug_multiline2/
│   ├── generated_images_debug_multiline_arrow/
│   ├── generated_images_debug_single_multire/
│   └── images/
├── synthetic/
│   ├── generated_images_debug/
│   ├── generated_images_debug_multiline/
│   ├── generated_images_debug_multiline2/
│   ├── generated_images_debug_multiline_arrow/
│   ├── generated_images_debug_single_multire/
│   └── images/
├── generated_images_debug.json
├── generated_images_debug_multiline.json
├── generated_images_debug_multiline2.json
├── generated_images_debug_multiline_arrow.json
├── generated_images_debug_single_multire.json
└── images.json

Dataset Utilization

The dataset aims to benefit curved arrow information extraction for understanding chemical reaction mechanisms.

This dataset can be used in different models, benchmarking the performance of object recognition.

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