Feature/formula arithmetics - #25

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molshape merged 15 commits into

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feature/formula-arithmetics

Nov 1, 2025

Commits on Oct 31, 2025

Add `ChemFormula.__add__` operator, tests and version bump to 1.5.1
molshape
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9f8a1bb
Update test files
molshape
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ee7376e
Update Documentation, add `CHANGELOG.md` and add example for formula arithmetics
molshape
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37babe3

Commits on Nov 1, 2025

Add `ChemFormulaDictFloat` class, modify `ChemFormulaDict` class and improve validation
molshape
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1d06a03
Addition returns chemical formula as a sum formula
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37be443
Merge pull request #22 from molshape/feature/adding-formulas
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a2a10a7
Implement `__sub__` operator and tests
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5421cf5
Update documentation and example
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9867a64
Merge pull request #23 from molshape/feature/subtracting-formulas
molshape
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aa26285
Implement `__mul__` and `__rmul__` operators and tests
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c1ef91c
Refactor `__mul__`
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1ebefc9
Update documentation and example
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23dfe3b
Merge pull request #24 from molshape/feature/multiply-formulas
molshape
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ad23f53
Hitfix to Documentation and Linting Config
molshape
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eff74d7
Update `pyproject.toml` and `ci.yml`
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5351caf