PyTorch Autodiff DFT-D4 Implementation.
APACHE-2.0 License
Torchmetrics - Machine learning metrics for distributed, scalable PyTorch applications.
TorchCFM: a Conditional Flow Matching library
A powerful and flexible machine learning platform for drug discovery
Efficient And Fully Differentiable Extended Tight-Binding
A deep learning package for many-body potential energy representation and molecular dynamics
PyTorch Autodiff DFT-D3 Implementation.
A PyTorch repo for data loading and utilities to be shared by the PyTorch domain libraries.
A Python module for compiling PyTorch graphs to C
Torch Distributed Experimental
PyTorch Autodiff Multicharge (Classical Charge Models).
Pytorch_Dart is a dart wrapper for Libtorch,striving to provide an experience identical to PyTorc...
Torchhd is a Python library for Hyperdimensional Computing and Vector Symbolic Architectures
Run PyTorch LLMs locally on servers, desktop and mobile
An I/O benchmark for deep Learning applications
PyTorch/TorchScript/FX compiler for NVIDIA GPUs using TensorRT