Releases: m3g/ComplexMixtures.jl
Releases · m3g/ComplexMixtures.jl
v2.1.9
ComplexMixtures v2.1.9
- improve error message of bulk_range defaults
- use kwargs in progress meter of grid3d to avoid warning of deprecation
v2.1.8
v2.1.7
- Update docs.
Full Changelog: v2.1.7...v2.1.7+docs1
v1.4.2
ComplexMixtures v1.4.2
- Restore compatibility with Julia 1.6
- Add warning for using an outdated version of ComplexMixtures.
v2.1.7
v2.1.6
v2.1.5
ComplexMixtures v2.1.5
- support SVector in Solute/Solvent group constructors.
- fix indexing of very large PDB files in grid3D
v2.1.4
- some formatting of the docs
v2.1.4
ComplexMixtures v2.1.4
- Sort indices of custom groups for faster searching. Improves somewhat the performance for large custom groups.
v2.1.3
ComplexMixtures v2.1.3
- local storage of parallel buffers: improvements in thread locality and memory management