Thread Author Last Post Replies
 Pinned

Welcome to this forum. Please introduce yourself.

Stewart Adcock [CCDC Staff]
Thu, 16 Jan 2020 15:10:24 GMT
Dikeos Mario Soumpasis
10
 Closed  Pinned

Version 3.0.2 released!

Dave Bardwell [CCDC Staff]
Thu, 12 Dec 2019 11:21:03 GMT
Dave Bardwell [CCDC Staff]
0
 Closed  Pinned

Welcome to the CSD Python API Forum

Peter Wood [CCDC Staff]
Mon, 29 Jun 2015 15:55:10 GMT
Peter Wood [CCDC Staff]
0

Chirality assessment

Toms Rekis
Tue, 19 Jan 2021 02:48:07 GMT
Anonymous
4

Downloading .cif files through the Python API

Anonymous
Mon, 11 Jan 2021 17:35:09 GMT
Anonymous
4

converting a directory of mol2 files to cif files

Koen Robeyns
Thu, 07 Jan 2021 08:26:42 GMT
Anonymous
3

Comparing two sets of conformers

Othman Al Bahri
Fri, 01 Jan 2021 10:42:36 GMT
Anonymous
3

how to find bond distance within crystal?

Anonymous
Thu, 31 Dec 2020 07:48:36 GMT
Anonymous
7

Filtering CSD for molecules with no disorder

CSD 
Puck van Gerwen
Wed, 30 Dec 2020 10:40:26 GMT
Anonymous
4

problems about install python-api-2.0 in centos7.5?

Crystal Conversations 
Anonymous
Sat, 26 Dec 2020 09:53:42 GMT
Anonymous
0

how to change HbondCoordination settings?

Anonymous
Thu, 24 Dec 2020 05:19:04 GMT
Anonymous
4

Searching the database based on structure void space

Martin Ward
Mon, 21 Dec 2020 12:07:04 GMT
Langworth nana
9

Detecting rigidity or flexibility of set of molecules

Tahereh
Mon, 21 Dec 2020 11:35:58 GMT
Anonymous
6

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Anonymous
Sat, 19 Dec 2020 05:30:32 GMT
Anonymous
0

Number of unique H-bonds

Toms Rekis
Thu, 17 Dec 2020 23:31:36 GMT
Toms Rekis
0

Is there any script for converting .cif files too good old ,pdb format?

Dikeos Mario Soumpasis
Tue, 15 Dec 2020 08:04:24 GMT
Anonymous
2

CIF to SMILE string

Anonymous
Tue, 15 Dec 2020 08:03:02 GMT
Anonymous
2

Data mining bond lengths

Anonymous
Tue, 15 Dec 2020 08:01:06 GMT
Anonymous
2

Jupyter notebook for CSD-python-API

Anonymous
Tue, 15 Dec 2020 07:32:06 GMT
Anonymous
15

Combine queries?

Pascal Parois
Tue, 15 Dec 2020 07:27:46 GMT
Anonymous
7

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