Trainable, memory-efficient, and GPU-friendly PyTorch reproduction of AlphaFold 2
APACHE-2.0 License
An End-to-End Framework for Molecular Conformation Generation via Bilevel Programming (ICML'21)
[ICLR 2024] Domain-Agnostic Molecular Generation with Chemical Feedback
An open source implementation of CLIP.
An open-source framework for training large multimodal models.
Learning Neural Generative Dynamics for Molecular Conformation Generation (ICLR 2021)
Python implementation of 3D Zernike moments with PyTorch