Fast Organic Crystal Structure Prediction with Unit Cell Flow Matching
3
17 commits
2 linked in READMEs
updated Jun 11, 2026
This repository contains data and checkpoints for the paper: Fast Organic Crystal Structure Prediction with Unit Cell Flow Matching (arXiv).
Available files are:
clari-huge.ckpt: Clari-H checkpoint (~354M params).clari-large.ckpt: Clari-L checkpoint (~173M params).clari-med.ckpt: Clari-M checkpoint (~88M params).csd-split.csv: CSD refcodes and the dataset split used in the paper.See the source code (GitHub) for instructions on training and inference.
The source code of Clari is released under the MIT License. However, Clari was trained on data from the Cambridge Structure Database (CSD). Therefore, the model weights are licensed under a Creative Commons Attribution-NonCommercial 4.0 International License (CC BY-NC 4.0). For commercial use of the model weights, please ensure that you have a proper CCDC License.
Fast Organic Crystal Structure Prediction with Unit Cell Flow Matching
3
17 commits
2 linked in READMEs
updated Jun 11, 2026
This repository contains data and checkpoints for the paper: Fast Organic Crystal Structure Prediction with Unit Cell Flow Matching (arXiv).
Available files are:
clari-huge.ckpt: Clari-H checkpoint (~354M params).clari-large.ckpt: Clari-L checkpoint (~173M params).clari-med.ckpt: Clari-M checkpoint (~88M params).csd-split.csv: CSD refcodes and the dataset split used in the paper.See the source code (GitHub) for instructions on training and inference.
The source code of Clari is released under the MIT License. However, Clari was trained on data from the Cambridge Structure Database (CSD). Therefore, the model weights are licensed under a Creative Commons Attribution-NonCommercial 4.0 International License (CC BY-NC 4.0). For commercial use of the model weights, please ensure that you have a proper CCDC License.