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Bump version. Update changelog
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kpzn768 committed Dec 18, 2024
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14 changes: 14 additions & 0 deletions CHANGELOG.md
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# CHANGELOG

## Version 1.8.0 - 2024-12-18

### Features

- DeepSet route scoring routines
- SCScore featurizer for molecules
- Routine for identifying symmetric sites on molecules
- Batch utilities for numpy arrays
- Reader for synthesis route from aizynthfinder dictionary

### Trivial changes

- Update dependencies

## Version 1.7.0 - 2024-10-15

### Features
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2 changes: 1 addition & 1 deletion docs/conf.py
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project = "ReactionUtils"
copyright = "2022-2024, Molecular AI group"
author = "Molecular AI group"
release = "1.7.0"
release = "1.8.0"

extensions = [
"sphinx.ext.autodoc",
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2 changes: 1 addition & 1 deletion pyproject.toml
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[tool.poetry]
name = "reaction_utils"
version = "1.7.0"
version = "1.8.0"
description = "Utilities for working with reactions, reaction templates and template extraction"
authors = ["Genheden, Samuel <samuel.genheden@astrazeneca.com>", "Kannas, Christos <christos.kannas@astrazeneca.com>"]
license = "Apache-2.0"
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