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Add Nannoolal et al. method
enhancement
New feature or request
#119
opened Sep 25, 2024 by
Aariq
1 of 2 tasks
Drop
ChemmineOB
as dependency and call OpenBabel more directly
difficulty: hard
#106
opened May 9, 2024 by
Aariq
Document all columns returned by Improvements or additions to documentation
get_fx_groups()
difficulty: low
documentation
#90
opened Dec 1, 2023 by
Aariq
Allow user to specify temperature
difficulty: medium
enhancement
New feature or request
priority: high
High priority
#41
opened Jun 28, 2023 by
Aariq
3 tasks done
ProTip!
Updated in the last three days: updated:>2024-12-31.