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Home » DataWarrior » Functionality
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  List Membership Filter
By: ELFritzen on Wed, 25 January 2023
2 1536 Thu, 09 February 2023 16:42
By: ELFritzen
  Docking score and Datawarrior
By: Jo W on Fri, 23 December 2022
5 3059 Sat, 04 February 2023 19:22
By: Jo W
  DW as a KNIME Plugin
KNIME
By: richards99 on Thu, 10 February 2022
4 3710 Fri, 03 February 2023 15:03
By: wsmts
  Copy and Paste 3D Pose
By: sbembenek18 on Sun, 08 January 2023
9 4299 Thu, 02 February 2023 23:26
By: sbembenek18
  Copy Images and Statistical value
Bug or Alzheimer
By: alienke on Thu, 02 February 2023
1 1138 Thu, 02 February 2023 23:04
By: nbehrnd
  How to add the "Structure of smile similarity" score to the colume
By: Shane on Mon, 30 January 2023
2 1454 Tue, 31 January 2023 03:53
By: Shane
  maximum number of bins/categories for bar charts
By: chemtv on Sat, 07 January 2023
3 2110 Thu, 19 January 2023 22:51
By: nbehrnd
  ChemAxon plugin
Activation of ChemAxon into DW
By: Christophe on Thu, 03 February 2022
14 10417 Thu, 01 December 2022 20:06
By: thomas
  Nasty functions
relation to PAINS?
By: sansun on Mon, 21 November 2022
1 1692 Mon, 21 November 2022 10:43
By: thomas
  Generate tautomers
By: Christophe on Thu, 27 October 2022
2 1810 Thu, 27 October 2022 15:54
By: Christophe
  bar graph Murcko Skeleton and count
file size issue perhaps
By: khom on Thu, 13 October 2022
2 1764 Wed, 19 October 2022 16:56
By: khom
  Feature Request
Additional Charting Options
By: amorrison on Thu, 13 October 2022
1 1278 Fri, 14 October 2022 19:33
By: thomas
  Jar file from Linux build
replacing the original datawarrior.jar file with the freshly built one
By: nats on Tue, 11 October 2022
2 2437 Wed, 12 October 2022 01:37
By: nats
  update/recalculation of all computed array data
By: nbehrnd on Tue, 13 September 2022
1 1415 Tue, 13 September 2022 22:02
By: thomas
  Macro for evolutionary library (EL) in Datwarrior (DW)
By: Jo W on Tue, 09 August 2022
22 11507 Tue, 13 September 2022 21:45
By: thomas
  Find & Replace or alternative for stereoisomers
By: Paul on Mon, 29 August 2022
2 1808 Wed, 31 August 2022 18:36
By: Paul
  Assign cluster name based on cluster size
By: mcmc on Thu, 07 April 2022
4 3592 Fri, 05 August 2022 07:46
By: DrCJM
  Updating columns
By: ChristerW on Thu, 16 June 2022
6 4519 Tue, 19 July 2022 05:43
By: sansun
  Medchem rules
one click option
By: sansun on Sat, 16 July 2022
0 1173 Sat, 16 July 2022 14:17
By: sansun
  Row wise chemical reaction
Wish to combine Carboxylic acids in one column with AA in another, not combinatorially
By: P_Fitz on Fri, 06 December 2019
12 13026 Thu, 14 July 2022 10:27
By: thomas
  Saving 2D-structure with labels
By: vijaymasand on Fri, 20 May 2022
10 8164 Sat, 02 July 2022 04:36
By: vijaymasand
  macro buildEvolutionaryLibrary from a mac terminal
macro buildEvolutionaryLibrary
By: Bruno on Sat, 04 June 2022
5 3875 Sat, 25 June 2022 12:55
By: thomas
  Export Superimposed structures
By: sbembenek18 on Thu, 14 April 2022
1 1708 Sun, 15 May 2022 17:08
By: thomas
  defining molecule clusters after similarity analysis
By: Xenia on Mon, 07 March 2022
2 2546 Fri, 29 April 2022 18:09
By: Xenia
  search for conformers, empty column «minimization error»
By: nbehrnd on Thu, 17 March 2022
1 1823 Wed, 06 April 2022 11:56
By: thomas
  Comparing Structure Files
proble to use the "Find similar compound in other file" tool
By: biolive31!! on Wed, 12 January 2022
9 7540 Tue, 05 April 2022 16:47
By: thomas
  Video tutorial on using Datawarrior to undertake QSAR predictions
QSAR predictions in Datawarrior
By: Jo W on Thu, 17 March 2022
3 3859 Mon, 04 April 2022 09:00
By: sansun
  Adjust font and size SALIplot
By: CarmineV on Sun, 20 February 2022
1 1980 Sat, 02 April 2022 17:38
By: thomas
  what parameters shall be used to create t-SNE or PCA visualization in Data Warrior
parameters for t-SNE or PCA visualization
By: yi02@hotmail.com on Fri, 04 March 2022
1 2652 Sat, 02 April 2022 17:28
By: thomas
  Skelspheres descriptor
Skelspheres descriptor
By: ECG93 on Fri, 04 March 2022
1 2195 Sat, 02 April 2022 17:15
By: thomas
  Chemistry in 3D
tutorials
By: Christophe on Thu, 17 March 2022
5 4575 Wed, 23 March 2022 12:45
By: Christophe
  How to perform general R group searches in DW
Substructure searches
By: Jo W on Tue, 28 December 2021
4 4989 Thu, 17 March 2022 22:42
By: nbehrnd
  Functionality request: MPO score
By: mvamos on Thu, 19 December 2019
7 12871 Thu, 17 March 2022 13:28
By: timritchie
  Opening a .csv file
Troubles to open .csv file
By: gdeutsch on Fri, 04 March 2022
2 2742 Mon, 07 March 2022 15:42
By: gdeutsch
  Became enamine database a sub-set of chemspace?
By: nbehrnd on Sun, 06 March 2022
1 2135 Sun, 06 March 2022 17:57
By: thomas
icon13.gif Enumeration of Libraries
More than fragments to be combined and enumerated
By: frytz on Fri, 04 February 2022
1 2152 Thu, 10 February 2022 11:04
By: thomas
  Auto create and disable range filter when null values found
By: nats on Tue, 08 February 2022
0 1382 Tue, 08 February 2022 06:28
By: nats
  C=C double bonds/search by extended stereochemistry
By: nbehrnd on Tue, 30 November 2021
1 2285 Tue, 11 January 2022 16:12
By: thomas
  Printing Form View Window to PDF
Printing Forms to PDF
By: Ringard on Thu, 23 December 2021
1 1965 Tue, 11 January 2022 15:45
By: thomas
  Embedded data
By: GiangLe on Wed, 03 November 2021
3 4211 Fri, 05 November 2021 08:37
By: thomas
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