Thread Author Last Post Replies

"Compound" field in entry/crystal/molecule classes

Geoffrey Wood
Wed, 26 Aug 2015 17:51:34 GMT
Geoffrey Wood
2

Your wishlist for the CSD Python API?

Stewart Adcock [CCDC Staff]
Tue, 24 Nov 2015 16:59:38 GMT
Stewart Adcock [CCDC Staff]
1

Modules under development in the API

Stewart Adcock [CCDC Staff]
Tue, 24 Nov 2015 16:55:04 GMT
Stewart Adcock [CCDC Staff]
1

Version 1.0 released!

Peter Wood [CCDC Staff]
Fri, 20 Nov 2015 16:00:05 GMT
Peter Wood [CCDC Staff]
0

Script to write crystal14 input files from list of refcodes

Rachel Skyner
Sat, 19 Sep 2015 13:46:52 GMT
Rachel Skyner
0

converting a directory of mol2 files to cif files

Koen Robeyns
Fri, 18 Sep 2015 10:38:43 GMT
Koen Robeyns
2

Script to Combine CIF files

Shyam Vyas [CCDC Staff]
Tue, 28 Jul 2015 13:55:31 GMT
Shyam Vyas [CCDC Staff]
0

Script to generate diagrams for all molecules in a structure file

Andy Maloney [CCDC Staff]
Tue, 07 Jul 2015 09:16:28 GMT
Andy Maloney [CCDC Staff]
0

Script to send a Mol2 (or CIF) file to an external application

Anonymous
Tue, 07 Jul 2015 08:26:06 GMT
Anonymous
0

Script to obtain PubChem information for a CSD entry

Paul Sanschagrin
Mon, 06 Jul 2015 15:13:31 GMT
Paul Sanschagrin
0

Script to run many substructure searches & collate results

Peter Wood [CCDC Staff]
Mon, 06 Jul 2015 11:00:32 GMT
Peter Wood [CCDC Staff]
0

You must be signed in to post in this forum.