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NMRDfromMD
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Merge pull request #4 from NMRDfromMD/change-T1-treatment
Python application
#57:
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simongravelle
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change the way T1 is treated
Python application
#56:
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#4
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simongravelle
40s
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Merge pull request #3 from NMRDfromMD/adding-Welford
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#55:
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Adding weldford to estimate error
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#54:
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Adding weldford to estimate error
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Adding weldford to estimate error
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Adding weldford to estimate error
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#51:
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Merge pull request #2 from NMRDfromMD/version-update
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updated version in setup
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#49:
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Merge pull request #1 from NMRDfromMD/my-fix
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minor update
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minor update
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made test more robust
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added atom selection test
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minor correction
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Updated README and created setup file
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#42:
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added physics validation test
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continue refactoring
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#40:
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updated NMR
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renamed function
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manage units
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Improved LONG DESCRIPTION
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#36:
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created more functions
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#35:
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updated geometry
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#34:
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removed scipy warning
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#33:
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