---
license: cc-by-4.0
configs:
- config_name: default
  data_files:
  - split: train
    path: data/train-*
  - split: test
    path: data/test-*
  - split: validation
    path: data/validation-*
dataset_info:
  features:
  - name: input
    dtype: string
  - name: mc_labels
    sequence: float64
  splits:
  - name: train
    num_bytes: 203939038678
    num_examples: 945455307
  - name: test
    num_bytes: 25523244912
    num_examples: 118890444
  - name: validation
    num_bytes: 24920275439
    num_examples: 118451032
  download_size: 270730145
  dataset_size: 254382559029
---

# SAFE

Sequential Attachment-based Fragment Embedding (SAFE) is a novel molecular line notation that represents molecules as an unordered sequence of fragment blocks to improve molecule design using generative models.

Find the details and how to use at SAFE in the repo https://github.com/datamol-io/safe or the paper https://arxiv.org/pdf/2310.10773.pdf.