|
|
Topic |
Replies |
Views |
Last message |
 |
 |
name vs score 2D plot |
10 |
235 |
Sat, 18 March 2023 17:55 By: thomas  |
 |
|
HBD/HBA |
5 |
1214 |
Sat, 18 March 2023 17:25 By: thomas  |
 |
|
histograms 2D view Requesting addition of an option to generate histograms (i.e. MW vs count) By: P_Fitz on Wed, 23 November 2022 |
2 |
368 |
Thu, 09 March 2023 01:34 By: P_Fitz  |
 |
|
Chemaxon pKa plugin |
0 |
99 |
Thu, 23 February 2023 19:29 By: matthewk  |
 |
|
Calculate number of dates between 2 dates By: Zioubi on Tue, 21 February 2023 |
2 |
130 |
Tue, 21 February 2023 10:46 By: Zioubi  |
 |
|
List Membership Filter |
2 |
236 |
Thu, 09 February 2023 16:42 By: ELFritzen  |
 |
|
Docking score and Datawarrior By: Jo W on Fri, 23 December 2022 |
5 |
560 |
Sat, 04 February 2023 19:22 By: Jo W  |
 |
|
DW as a KNIME Plugin KNIME |
4 |
1675 |
Fri, 03 February 2023 15:03 By: wsmts  |
 |
|
Copy and Paste 3D Pose |
9 |
1059 |
Thu, 02 February 2023 23:26 By: sbembenek18  |
 |
|
Copy Images and Statistical value Bug or Alzheimer By: alienke on Thu, 02 February 2023 |
1 |
215 |
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 |
298 |
Tue, 31 January 2023 03:53 By: Shane  |
 |
|
maximum number of bins/categories for bar charts By: chemtv on Sat, 07 January 2023 |
3 |
328 |
Thu, 19 January 2023 22:51 By: nbehrnd  |
 |
|
ChemAxon plugin Activation of ChemAxon into DW |
14 |
5442 |
Thu, 01 December 2022 20:06 By: thomas  |
 |
|
Nasty functions relation to PAINS? By: sansun on Mon, 21 November 2022 |
1 |
414 |
Mon, 21 November 2022 10:43 By: thomas  |
 |
|
Generate tautomers |
2 |
632 |
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 |
659 |
Wed, 19 October 2022 16:56 By: khom  |
 |
|
Feature Request Additional Charting Options |
1 |
495 |
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 |
662 |
Wed, 12 October 2022 01:37 By: nats  |
 |
|
update/recalculation of all computed array data By: nbehrnd on Tue, 13 September 2022 |
1 |
604 |
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 |
4727 |
Tue, 13 September 2022 21:45 By: thomas  |
 |
|
Find & Replace or alternative for stereoisomers By: Paul on Mon, 29 August 2022 |
2 |
748 |
Wed, 31 August 2022 18:36 By: Paul  |
 |
|
Assign cluster name based on cluster size By: mcmc on Thu, 07 April 2022 |
4 |
1961 |
Fri, 05 August 2022 07:46 By: DrCJM  |
 |
|
Updating columns |
6 |
2442 |
Tue, 19 July 2022 05:43 By: sansun  |
 |
|
Medchem rules one click option By: sansun on Sat, 16 July 2022 |
0 |
569 |
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 |
9210 |
Thu, 14 July 2022 10:27 By: thomas  |
 |
|
Search for "any atom" in structure editor |
1 |
840 |
Wed, 13 July 2022 22:30 By: thomas  |
 |
|
Saving 2D-structure with labels |
10 |
3359 |
Sat, 02 July 2022 04:36 By: vijaymasand  |
 |
|
macro buildEvolutionaryLibrary from a mac terminal macro buildEvolutionaryLibrary By: Bruno on Sat, 04 June 2022 |
5 |
2059 |
Sat, 25 June 2022 12:55 By: thomas  |
 |
|
Export Superimposed structures |
1 |
952 |
Sun, 15 May 2022 17:08 By: thomas  |
 |
|
defining molecule clusters after similarity analysis By: Xenia on Mon, 07 March 2022 |
2 |
1512 |
Fri, 29 April 2022 18:09 By: Xenia  |
 |
|
search for conformers, empty column «minimization error» |
1 |
1073 |
Wed, 06 April 2022 11:56 By: thomas  |
 |
|
Comparing Structure Files proble to use the "Find similar compound in other file" tool |
9 |
4408 |
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 |
2098 |
Mon, 04 April 2022 09:00 By: sansun  |
 |
|
Adjust font and size SALIplot |
1 |
1099 |
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 |
1 |
1362 |
Sat, 02 April 2022 17:28 By: thomas  |
 |
|
Skelspheres descriptor Skelspheres descriptor By: ECG93 on Fri, 04 March 2022 |
1 |
1248 |
Sat, 02 April 2022 17:15 By: thomas  |
 |
|
Chemistry in 3D tutorials |
5 |
2537 |
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 |
2813 |
Thu, 17 March 2022 22:42 By: nbehrnd  |
 |
|
Functionality request: MPO score By: mvamos on Thu, 19 December 2019 |
7 |
9505 |
Thu, 17 March 2022 13:28 By: timritchie  |
 |
|
Opening a .csv file Troubles to open .csv file |
2 |
1585 |
Mon, 07 March 2022 15:42 By: gdeutsch  |