diff --git a/metatomic-torch/CHANGELOG.md b/metatomic-torch/CHANGELOG.md index 5f62b18d..3c140e92 100644 --- a/metatomic-torch/CHANGELOG.md +++ b/metatomic-torch/CHANGELOG.md @@ -17,6 +17,19 @@ a changelog](https://keepachangelog.com/en/1.1.0/) format. This project follows ### Removed --> +## [Version 0.1.8](https://github.com/metatensor/metatomic/releases/tag/metatomic-torch-v0.1.8) - 2026-02-02 + +### Added + +- Added the ability for models to request extra inputs from the simulation + engine, on top of positions/cell/types. These extra inputs are requested by + the model and stored on the system by the engine (like for neighbor lists). + They are provided as TensorMap, stored in the system's data, and follow the + same metadata structure as the standard outputs (anything that can be an output can also be an input). +- Added support for `charges`, `masses`, `velocities` as standard model inputs + and outputs +- Added support for PyTorch v2.10 + ### Changed - Properties in standard output/inputs should now consistently use singular diff --git a/metatomic-torch/VERSION b/metatomic-torch/VERSION index 11808190..699c6c6d 100644 --- a/metatomic-torch/VERSION +++ b/metatomic-torch/VERSION @@ -1 +1 @@ -0.1.7 +0.1.8 diff --git a/metatomic-torch/tests/cmake-project/CMakeLists.txt b/metatomic-torch/tests/cmake-project/CMakeLists.txt index 27d5e467..349f78ab 100644 --- a/metatomic-torch/tests/cmake-project/CMakeLists.txt +++ b/metatomic-torch/tests/cmake-project/CMakeLists.txt @@ -20,7 +20,7 @@ else() # REQUIRED_METATOMIC_TORCH_VERSION in the same way we update the # metatomic-torch version include(../../cmake/dev-versions.cmake) - set(REQUIRED_METATOMIC_TORCH_VERSION "0.1.7") + set(REQUIRED_METATOMIC_TORCH_VERSION "0.1.8") create_development_version("${REQUIRED_METATOMIC_TORCH_VERSION}" METATOMIC_TORCH_FULL_VERSION "metatomic-torch-v") string(REGEX REPLACE "([0-9]*)\\.([0-9]*).*" "\\1.\\2" REQUIRED_METATOMIC_TORCH_VERSION ${METATOMIC_TORCH_FULL_VERSION})