diff --git a/Cargo.lock b/Cargo.lock index 7c19573..a3f4dda 100644 --- a/Cargo.lock +++ b/Cargo.lock @@ -25,7 +25,7 @@ checksum = "5192cca8006f1fd4f7237516f40fa183bb07f8fbdfedaa0036de5ea9b0b45e78" [[package]] name = "atompack" -version = "0.2.1" +version = "0.3.0" dependencies = [ "bincode", "bytemuck", @@ -44,7 +44,7 @@ dependencies = [ [[package]] name = "atompack-py" -version = "0.2.1" +version = "0.3.0" dependencies = [ "atompack", "bincode", diff --git a/Cargo.toml b/Cargo.toml index e9ad78e..e9a85aa 100644 --- a/Cargo.toml +++ b/Cargo.toml @@ -3,10 +3,11 @@ members = ["atompack", "atompack-py"] resolver = "2" [workspace.package] -version = "0.2.1" +version = "0.3.0" edition = "2024" authors = [ "Ali Ramlaoui ", + "Daniel Speckhard ", "Victor Schmidt ", ] license = "Apache-2.0" diff --git a/atompack-py/pyproject.toml b/atompack-py/pyproject.toml index 828722c..e5d3b24 100644 --- a/atompack-py/pyproject.toml +++ b/atompack-py/pyproject.toml @@ -4,10 +4,11 @@ build-backend = "maturin" [project] name = "atompack-db" -version = "0.2.1" +version = "0.3.0" description = "Fast, compressed storage for atomic structures with properties." authors = [ {name = "Ali Ramlaoui", email = "ali.ramlaoui@entalpic.ai"}, + {name = "Daniel Speckhard", email = "daniel.speckhard@entalpic.ai"}, {name = "Victor Schmidt", email = "victor.schmidt@entalpic.ai"} ] readme = "README.md" diff --git a/atompack-py/python/atompack/__init__.py b/atompack-py/python/atompack/__init__.py index 34b97bb..9d9441a 100644 --- a/atompack-py/python/atompack/__init__.py +++ b/atompack-py/python/atompack/__init__.py @@ -43,7 +43,7 @@ from ._atompack_rs import PyMolecule as Molecule from .ase_bridge import add_ase_batch, from_ase, to_ase, to_ase_batch -__version__ = "0.2.1" +__version__ = "0.3.0" __all__ = [ "Atom", "Molecule", diff --git a/atompack-py/uv.lock b/atompack-py/uv.lock index 02f311c..0ed36bb 100644 --- a/atompack-py/uv.lock +++ b/atompack-py/uv.lock @@ -166,7 +166,7 @@ wheels = [ [[package]] name = "atompack-db" -version = "0.2.1" +version = "0.3.0" source = { editable = "." } dependencies = [ { name = "huggingface-hub", version = "0.36.2", source = { registry = "https://pypi.org/simple" }, marker = "python_full_version < '3.9'" }, diff --git a/docs/source/conf.py b/docs/source/conf.py index 61a6015..96ff25e 100644 --- a/docs/source/conf.py +++ b/docs/source/conf.py @@ -11,7 +11,7 @@ copyright = "2026, Entalpic" author = "Ali Ramlaoui and contributors" # Contributors to the package release = ( - "0.2.1" # Current version of the package, can be retrieved programmatically too. + "0.3.0" # Current version of the package, can be retrieved programmatically too. ) # -- General configuration ---------------------------------------------------