aiqm / torchani
TorchANI 2.0 is an open-source library that supports training, development, and research of ANI-style neural network interatomic potentials. It was originally developed and is currently maintained by the Roitberg group.
- Repository stars
- 567All-time #57,164
- Fork
- 139
- Last push
- updated 11 days ago
- Repository created
- since 2018
About
TorchANI 2.0 is an open-source library that supports training, development, and research of ANI-style neural network interatomic potentials. It was originally developed and is currently maintained by the Roitberg group.Summarised by AI from the README; the original prevails
Author description: TorchANI 2.0 is an open-source library that supports training, development, and research of ANI-style neural network interatomic potentials. It was originally developed and is currently maintained by the Roitberg group.
Basic listing based on official public information; functionality has not been independently evaluated.
- Pricing
- Pricing not verifiedCheck current official software, hosting, model and infrastructure pricing.