v0.3.0

What's Changed

• Fileio by @tdpham2 in #65
• Add MCP capability to ChemGraph by @tdpham2 in #67
• Add examples for using MCP on Aurora by @tdpham2 in #68
• Update pyproject.toml by @tdpham2 in #69
• Major Update: MCP Integration, ToolNode Refactor, and Notebook Refresh by @tdpham2 in #70
• Add gRASPA + Parsl + MCP capability for ChemGraph by @tdpham2 in #71
• Update package for PyPI release v0.2.0 by @keceli in #72
• Major changes with refactor: name changes, MCP, ALCF machine Parsl configs and unit tests by @tdpham2 in #74
• Minor changes to MCP, visualization and models by @tdpham2 in #76
• Add unit test for MCP servers and simple agent workflow by @tdpham2 in #77
• Add CI/CD workflow for dev branch by @tdpham2 in #78
• Update Polaris Parsl config by @tdpham2 in #79
• Add async pytest and update dev workflow to avoid Windows for now by @tdpham2 in #80
• Fix Argo endpoint handling and UI robustness by @keceli in #82
• Fix #84 Gemini API error: Add proper type annotation for dipole_value field by @arkaslittlemind in #85
• Major changes: MCP, File IO, HPC support by @tdpham2 in #81

New Contributors

• @arkaslittlemind made their first contribution in #85

Full Changelog: v2025.09.12...v0.3.0