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Issues list

How to run AutoTST
#81 opened Jun 7, 2020 by AH9316
log to TS
#75 opened May 5, 2020 by davidfarinajr
Look into ASE Gaussian Optimizers
#72 opened Apr 14, 2020 by nateharms
input file for Job
#65 opened Mar 9, 2020 by davidfarinajr
Be ready to run many jobs in parallel
#44 opened Oct 1, 2019 by rwest
Optimize RMSD value
#42 opened Sep 25, 2019 by davidfarinajr
reduce computational cost
#32 opened Jul 16, 2019 by davidfarinajr
Examples and iPython Notebooks are out of date bug Something isn't working
#18 opened Mar 28, 2019 by nateharms
Addition of Hindered Rotor Calculations to AutoTST missing feature Something is missing and needs to be added
#16 opened Mar 28, 2019 by nateharms
2 tasks
Add additional calculators to AutoTST missing feature Something is missing and needs to be added
#15 opened Mar 28, 2019 by nateharms
2 tasks
ProTip! Follow long discussions with comments:>50.