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[Kernel Submission | CuTe DSL] - Fused Triangle Multiplicative Updates for AlphaFold3 Family Models
#26
by monteirot - opened
Hello everyone!!!
I created fast_trimul, an open-source, hardware-agnostic Python library providing Fused Triangle Multiplicative Updates for AlphaFold3 family models (including OpenFold-3, Boltz-1, Protenix, etc.).
The kernel was written in the Python CuTe DSL under Apache-2.0.
Key Highlights
- Performance: Runs 4.5โ6.8ร faster on short sequences compared to standard implementations (and up to 6.1ร faster for small sequence lenghts).
- VRAM Savings: Cuts peak GPU memory by 2.2โ2.4ร (N=2048โ2560), enabling ~1.4ร longer sequences before OOM.
- Zero Recompilation Overhead: Handles dynamic sequence lengths without re-triggering CUDA graph/compilation overheads (unlike
torch.compile). - Safety & Fallback: Exact output parity (difference ~0.0006%) with automatic fallback to PyTorch on failure to prevent runtime crashes.
- Extensible Architecture: Written using Python CuTe DSL with modular plugins, making it easy to adapt for new hardware targets (e.g., H100, B200) or frameworks.
In End-to-End OpenFold-3 Performance, it provides an overall 1.15โ1.33ร full-stack model speedup when integrated into OpenFold-3 for small sequence lenghts.
I would like to submit the kernel here of the library, but I need access to do so.
Benchmark & Code
- Repository: https://github.com/tiagomonteiro0715/fast_trimul
- PyPI: https://pypi.org/project/fast_trimul/
All these statistics are explained in detail in the GitHub repo.