PyPI - rust-sasa-python - Versions diffs - 0.5.0__tar.gz → 0.6.0__tar.gz - Mend

rust-sasa-python 0.5.0tar.gz → 0.6.0tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.

Files changed (17) hide show

{rust_sasa_python-0.5.0 → rust_sasa_python-0.6.0}/Cargo.lock RENAMED Viewed

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-checksum = "0a6e035dd0599267ce1ee132e51c27dd29437f63325753051e71dd9e42406c57"
-[[package]]
-name = "windows_x86_64_msvc"
-version = "0.52.6"
-source = "registry+https://github.com/rust-lang/crates.io-index"
-checksum = "589f6da84c646204747d1270a2a5661ea66ed1cced2631d546fdfb155959f9ec"
-[[package]]
-name = "windows_x86_64_msvc"
-version = "0.53.0"
-source = "registry+https://github.com/rust-lang/crates.io-index"
-checksum = "271414315aff87387382ec3d271b52d7ae78726f5d44ac98b4f4030c91880486"

{rust_sasa_python-0.5.0 → rust_sasa_python-0.6.0}/Cargo.toml RENAMED Viewed

@@ -1,6 +1,6 @@
 [package]
 name = "rust-sasa-python"
-version = "0.5.0"
+version = "0.6.0"
 edition = "2024"
 readme = "README.md"
@@ -12,7 +12,7 @@ crate-type = ["cdylib"]
 [dependencies]
 pdbtbx = "0.12.0"
 pyo3 = "0.25.1"
-rust-sasa = "0.7.0"
+rust-sasa = "0.8.0"
 nalgebra = "0.33.2"
 mimalloc = "0.1.47"
 num-complex = "0.4.6"

{rust_sasa_python-0.5.0 → rust_sasa_python-0.6.0}/PKG-INFO RENAMED Viewed

@@ -1,6 +1,6 @@
 Metadata-Version: 2.4
 Name: rust-sasa-python
-Version: 0.5.0
+Version: 0.6.0
 Classifier: Programming Language :: Rust
 Classifier: Programming Language :: Python :: Implementation :: CPython
 Classifier: Programming Language :: Python :: Implementation :: PyPy

{rust_sasa_python-0.5.0 → rust_sasa_python-0.6.0}/src/lib.rs RENAMED Viewed

@@ -372,7 +372,7 @@ pub fn calculate_sasa_internal(
         .into_iter()
         .enumerate()
         .map(|(index, (pos, radius, parent_id))| Atom {
-            position: Point3::new(pos.0, pos.1, pos.2),
+            position: [pos.0, pos.1, pos.2],
             id: index,
             parent_id: Some(parent_id as isize),
             radius,