stanstrup/PredRet

Issues

• Failure to make registration for the website

  #84 opened 2 years ago by YANGJJ93MS
  1

• the application unexpectedly exited

  #85 opened a year ago by julienparinet1
  1

• mongoDB connection

  #86 opened 8 months ago by margheritacurti
  1

• Run Time Estimate

  #83 opened 3 years ago by angepoch
  3

• Unable to delete "selected data"

  #82 opened 4 years ago by CBMollerup
  4

• upload error

  #80 opened 5 years ago by HansVissers
  14

• How to run the PredRet within R?

  #81 opened 5 years ago by Danissss
  6

• Upload Data Error

  #78 opened 5 years ago by qaporter
  1

• Retention time prediction tool "socket hang up" error

  #77 opened 6 years ago by jonstrutz11
  3

• Server appears busy

  #74 opened 6 years ago by Dorrain
  1

• The application unexpectedly exited.

  #75 opened 6 years ago by soallard
  5

• “No mongoDB connection”

  #76 opened 6 years ago by Dorrain
  2

• No mongoDB connection

  #73 opened 7 years ago by Dorrain
  1

• update rpubchem on server

  #72 opened 7 years ago by stanstrup
  0

• No mongoDB connection!

  #69 opened 7 years ago by dicarez
  7

• Problem of Inchi reading

  #71 opened 7 years ago by Pmicheau
  1

• Invalid inchi are ignored by obabel

  #70 opened 7 years ago by stanstrup
  0

• Make it impossible to add data to systems you don't "own"

  #68 opened 8 years ago by stanstrup
  0

• switch to webchem package

  #67 opened 8 years ago by stanstrup
  0

• Potential race condition: systems_in_db() called twice

  #66 opened 8 years ago by sneumann
  1

• add public function to plot models

  #61 opened 9 years ago by stanstrup
  1

• Update website with complete guide including screenshots

  #64 opened 9 years ago by stanstrup
  0

• add structure based prediction

  #42 opened 9 years ago by stanstrup
  3

• if CIs are very narrow don't mark compounds as suspect

  #60 opened 9 years ago by stanstrup
  0

• re-write to purge suspects at some useful point

  #63 opened 9 years ago by stanstrup
  0

• convert long script to functions (server_upload_tab_process_data.R)

  #62 opened 9 years ago by stanstrup
  1

• Use ontologies for chromatographic systems

  #58 opened 9 years ago by stanstrup
  1

• clean up sanity check of upload data and convert long script to functions

  #59 opened 9 years ago by stanstrup
  0

• cyclic re-read of database in the add systems dialog

  #57 opened 9 years ago by stanstrup
  0

• consider changing to the scam package

  #55 opened 9 years ago by stanstrup
  1

• CIs are not "multiple testing" corrected

  #54 opened 9 years ago by stanstrup
  0

• investigate if scam can replace gam+bootstrapping

  #56 opened 9 years ago by stanstrup
  0

• Check if the number of bootstraps can be reduced

  #52 opened 9 years ago by stanstrup
  1

• optimize sigmoidal function parameters

  #53 opened 9 years ago by stanstrup
  0

• no longer makes sense to call it loess_boot

  #51 opened 9 years ago by stanstrup
  0

• Add functions for users to query data

  #50 opened 9 years ago by stanstrup
  0

• Move functions into a package

  #46 opened 10 years ago by stanstrup
  0

• Make a list of suspect values for the user to inspect

  #40 opened 10 years ago by stanstrup
  0

• Make button to purge models

  #48 opened 10 years ago by stanstrup
  0

• separate RP and HILIC systems.

  #39 opened 10 years ago by stanstrup
  1

• purge prediction stats when purging predictions

  #49 opened 10 years ago by stanstrup
  0

• Check if structural similarity can be used to predict RT

  #47 opened 10 years ago by stanstrup
  1

• system templates

  #45 opened 10 years ago by stanstrup
  0

• Make compound list filters

  #41 opened 10 years ago by stanstrup
  0

• better consistency between field names

  #44 opened 10 years ago by stanstrup
  0

• Make tab where all data can be downloaded

  #43 opened 10 years ago by stanstrup
  0

• Better detection of presence of the correct columns

  #37 opened 10 years ago by stanstrup
  1

• Add statistics to prediction page

  #35 opened 10 years ago by stanstrup
  0

• Make sure a system cannot be added without a name

  #36 opened 10 years ago by stanstrup
  0

• Add progress indicator to upload page

  #38 opened 10 years ago by stanstrup
  0