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1. Proteina-Complexa Proteina-Complexa Public

   Generative model for protein binder design for protein and small molecule targets. Combines a pretrained flow-based generative model (built on La-Proteina) with inference-time optimization.

   Python 267 31

2. boltz-cp boltz-cp Public

   Context Parallelism Code for Boltz-2

   Python 28 2

3. nvQSP nvQSP Public

   GPU-accelerated Quantitative Systems Pharmacology (QSP) ODE solvers.

   9 1

4. RNAPro RNAPro Public

   RNAPro is a state-of-the-art RNA 3D folding model developed in collaboration with the hosts and winners of the Stanford RNA 3D Folding Kaggle competition.

   Python 75 16

5. nvMolKit nvMolKit Public

   A high-performance, GPU-accelerated library for key computational chemistry tasks, such as molecular similarity, conformer generation, and geometry relaxation.

   Cuda 241 21

6. CodonFM CodonFM Public

   A family of codon-resolution language models trained on 130 million protein-coding sequences from over 20,000 species.

   Python 69 11