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V1.5.1 #201

Merged
merged 12 commits into from
Aug 1, 2022
Merged

V1.5.1 #201

merged 12 commits into from
Aug 1, 2022

Commits on Jul 27, 2022

  1. correct deprotonation selection #198

    @a-r-j
    a-r-j committed Jul 27, 2022
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  2. Add MSE to constants #200

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    a-r-j committed Jul 27, 2022
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  3. fix chain id check in atomic edges #199

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    a-r-j committed Jul 27, 2022
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  4. missing comma

    @a-r-j
    a-r-j committed Jul 27, 2022
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  5. fix code smell

    @a-r-j
    a-r-j committed Jul 27, 2022
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Commits on Aug 1, 2022

  1. black

    @a-r-j
    a-r-j committed Aug 1, 2022
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  2. fix input validation

    @a-r-j
    a-r-j committed Aug 1, 2022
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  3. fix input validation

    @a-r-j
    a-r-j committed Aug 1, 2022
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  4. fix input validation

    @a-r-j
    a-r-j committed Aug 1, 2022
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  5. fix input validation

    @a-r-j
    a-r-j committed Aug 1, 2022
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  6. fix input validation

    @a-r-j
    a-r-j committed Aug 1, 2022
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  7. update changelog

    @a-r-j
    a-r-j committed Aug 1, 2022
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