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Issues: MolSSI/QCArchiveWebapps
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RDS: some rxn geometries cause an error
bug
Something isn't working
data
rds
Related to the Reaction Dataset webapp
RDS: sort basis sets by size
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
#52
opened Mar 3, 2020 by
mattwelborn
TTS: Pass molecule parsing error up to the user
bug
Something isn't working
tts
Related to the time-to-solution webapp
TTS: Display list of available methods
enhancement
New feature or request
tts
Related to the time-to-solution webapp
RDS: make it possible to compare CP to noCP
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
RDS: Convey which basis sets are available for which methods
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
RDS: context-specific "tips"
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
RDS: accuracy versus execution time plot
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
RDS: pre-defined views
enhancement
New feature or request
rds
Related to the Reaction Dataset webapp
RDS: notify user if a requested method/basis combination is not available
bug
Something isn't working
rds
Related to the Reaction Dataset webapp
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