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Commits on Aug 25, 2021

• Delete GoodVibes_sTRG.py

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• Delete G_TS_from_xyz.py

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• Delete G_from_xyz.py

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• Delete conf_search.py

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• Add files via upload

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Commits on Mar 4, 2021

• Added parsing of IRC structures with solvation

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Commits on Apr 27, 2020

• Add files via upload

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Commits on May 20, 2019

• removed bugs with missing dihedral or angle sections

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• Fixed bug with automatic naming of Job

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Commits on Mar 14, 2019

• Removed bug where jobname was wrongly detected

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Commits on Mar 2, 2019

• Delete DIA_reduce_reorder.cpython-37.pyc

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• Delete DIA_inputparser.cpython-37.pyc

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• Delete DIA_inputparser.cpython-32.pyc

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• Delete DIA_analysis.cpython-37.pyc

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• Merge pull request #1 from dsvatunek/add-license-1

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• Create LICENSE

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• Cosmetic

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Commits on Mar 1, 2019

• Consistency in naming

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• UnixFF

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• Rename

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• Update README.md

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Commits on Feb 22, 2019

• Update README.md

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• Update README.md

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• added Gaussian Force field energy parsing

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Commits on Feb 19, 2019

• Update requirements.txt

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• Create requirements.txt

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• Cleaned up input example

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• Merge branch 'master' of https://github.com/dsvatunek/autoDIA

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• Removed byte code

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• Update README.md

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• Update README.md

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• Update README.md

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• cosmetic changes

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• Example scripts for plotting

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• Handle more input errors

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