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retreive data from sqlite database? By: wsmts on Tue, 30 January 2024 |
1 |
2030 |
Thu, 01 February 2024 12:01
By: wsmts  |
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manually highlight atom/substructure in structure editor and structrue cell
is it possible to highlight or color atom/substructure in structure editor and structrue cell? By: Hong on Mon, 08 January 2024 |
2 |
3522 |
Mon, 08 January 2024 13:14
By: Hong |
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Bypass "Maximum number of open filters reached." message on file open? By: Andrew0 on Tue, 28 November 2023 |
6 |
5791 |
Fri, 05 January 2024 22:16
By: Andrew0 |
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the font size of GUI
font size By: albumns on Sun, 31 December 2023 |
1 |
2335 |
Sun, 31 December 2023 12:37
By: thomas |
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is there a way to continue a macro file on a saved file?
I would like to continue a macro using the Save visible as ... |
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2173 |
Sat, 23 December 2023 12:23
By: juliocoll |
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Generating derivatives of parent structure By: lutek14 on Sun, 05 November 2023 |
4 |
4933 |
Sat, 09 December 2023 00:42
By: thomas |
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Generate Explanation view based on the data from table
Generate Explanation view based on the data from table |
0 |
1431 |
Thu, 07 December 2023 12:35
By: helloWorld22 |
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FlyingObjects.dwar's picture and description fields
How to create a visualization like flyingobjects.dwar? By: etcdata on Fri, 02 February 2018 |
5 |
14854 |
Thu, 23 November 2023 11:24
By: helloWorld22 |
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 feature suggest: array cleaning by delete button By: nbehrnd on Fri, 27 October 2023 |
2 |
3224 |
Sat, 04 November 2023 20:19
By: nbehrnd |
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non-toxic Build Evolutionary Library
possible checking for individual molecular toxicity molecules during selection |
6 |
7140 |
Sun, 08 October 2023 22:50
By: juliocoll |
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extension of substructure definition |
5 |
6088 |
Sun, 17 September 2023 21:32
By: thomas |
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unable to create new filters
in dwar files I cannot add or create new filters because "uncaught exception:-1" |
3 |
3960 |
Wed, 13 September 2023 18:54
By: thomas |
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Splitting reactants column |
4 |
4847 |
Sun, 10 September 2023 14:47
By: thomas |
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Tab delimited txt / open special
Functionality not as described By: CEADOG on Wed, 02 August 2023 |
3 |
3881 |
Sat, 09 September 2023 21:47
By: thomas |
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Category Filter logic By: chemtv on Wed, 18 November 2020 |
6 |
11490 |
Thu, 07 September 2023 22:31
By: nbehrnd |
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thresholds and weights of toxicity risk |
2 |
3124 |
Fri, 25 August 2023 10:21
By: nbehrnd |
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Generating Hyperspace input |
0 |
1450 |
Thu, 24 August 2023 17:25
By: and_tos |
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correct input of charged reference structures, evolutionary libraries |
0 |
1657 |
Tue, 22 August 2023 18:53
By: nbehrnd |
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Quick Copy & Paste |
2 |
3035 |
Thu, 27 July 2023 20:55
By: jeusamio |
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Comparing Structures from two Datawarrior Files |
4 |
4765 |
Mon, 17 July 2023 17:06
By: ELFritzen |
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Deleting 3D Confomers By: umaed on Fri, 14 July 2023 |
2 |
2872 |
Fri, 14 July 2023 13:01
By: umaed |
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Chemaxon pKa plugin |
2 |
3781 |
Wed, 12 July 2023 15:29
By: thomas |
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handling ultra large space
DB sizes and scaling By: jrs11 on Thu, 06 July 2023 |
0 |
1722 |
Thu, 06 July 2023 00:07
By: jrs11 |
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Filter out nasty functions
to design a macro to filter all nasty functions their names should be included |
20 |
21874 |
Thu, 15 June 2023 16:40
By: juliocoll |
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Color a Row |
1 |
2477 |
Wed, 14 June 2023 20:53
By: thomas |
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is it possible to find text By: Ashley on Wed, 14 June 2023 |
1 |
7824 |
Wed, 14 June 2023 20:50
By: thomas |
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Row Wise Sum |
2 |
3518 |
Wed, 14 June 2023 08:44
By: amorrison |
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Unable to Create New Form
No "New Form View" Option |
1 |
2565 |
Fri, 09 June 2023 17:11
By: thomas |
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'Search ChEMBL Database' function
Problem with substructure search |
4 |
10706 |
Sat, 27 May 2023 18:01
By: thomas |
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Calculating similarity to one query compound
molecular similarity |
3 |
13398 |
Mon, 22 May 2023 21:55
By: thomas |
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Add reaction from structure |
3 |
4313 |
Mon, 22 May 2023 21:24
By: thomas |
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showing variable txt/values at "showMessage" macros
Trying to show variable txt/values to follow up WP macro code designs |
4 |
5368 |
Fri, 12 May 2023 13:01
By: juliocoll |
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Search for "any atom" in structure editor |
3 |
5518 |
Sat, 29 April 2023 13:50
By: thomas |
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Opening .CSV file
Error when opening .csv file |
1 |
2868 |
Mon, 27 March 2023 13:58
By: thomas |
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name vs score 2D plot |
10 |
10044 |
Sat, 18 March 2023 17:55
By: thomas |
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HBD/HBA |
5 |
8961 |
Sat, 18 March 2023 17:25
By: thomas |
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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 |
3606 |
Thu, 09 March 2023 01:34
By: P_Fitz |
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Calculate number of dates between 2 dates By: Zioubi on Tue, 21 February 2023 |
2 |
3029 |
Tue, 21 February 2023 10:46
By: Zioubi |
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List Membership Filter |
2 |
3637 |
Thu, 09 February 2023 16:42
By: ELFritzen |
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Docking score and Datawarrior By: Jo W on Fri, 23 December 2022 |
5 |
7817 |
Sat, 04 February 2023 19:22
By: Jo W |
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