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handle turbomole case where element at end of line #138

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merged 1 commit into from
Sep 25, 2019
Merged

handle turbomole case where element at end of line #138

merged 1 commit into from
Sep 25, 2019

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loriab
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@loriab loriab commented Sep 24, 2019

minor modifications of #137 so that the format commands work for turbomole, too

@dgasmith
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@eljost please review.

eljost
eljost approved these changes Sep 25, 2019
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Looks good. I just tested the produced coord string with Turbomole and TM can successfully read the file.

@dgasmith dgasmith merged commit 9cd825a into MolSSI:master Sep 25, 2019
@loriab loriab deleted the turbomoletostring branch March 2, 2020 19:44
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@dgasmith dgasmith dgasmith approved these changes

@eljost eljost eljost approved these changes

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@loriab @dgasmith @eljost