Crystallography - The Cambridge Crystallographic Data Centre (CCDC)

	Thread	Author	Last Post	Replies
	Adding atoms as donors/acceptor to hbonds of crystal	Anonymous	Mon, 12 Nov 2018 17:07:02 GMT Richard Sykes [CCDC Staff]	1
	Electron density	Anonymous	Wed, 07 Nov 2018 16:32:20 GMT Seth Wiggin [CCDC Staff]	1
	Coordinates of all the molecules in the unit cell	Tahereh	Wed, 31 Oct 2018 15:18:50 GMT Tahereh	6
	calculating atom distance across the unit cell boundary CSD	Xiwen Jia	Sun, 07 Oct 2018 10:39:48 GMT Anonymous	5
	Change spacegroup to subgroup	Aurora Cruz Cabeza	Mon, 06 Aug 2018 13:54:46 GMT Richard Sykes [CCDC Staff]	3
	How many different element types in a structure? ConQuest Mercury CSD Database Group	Caroline Davies	Thu, 24 May 2018 09:15:07 GMT Caroline Davies	0
	Downloading a long list of structures CSD Database Group	Anthony Nash	Thu, 10 May 2018 16:34:25 GMT Richard Sykes [CCDC Staff]	1
	finding covalently bonded clusters in crystal structures CSD	Xiwen Jia	Thu, 22 Jun 2017 21:36:18 GMT Xiwen Jia	14
	Saving Partial Coordinates Based on Search Query ConQuest CSD	Marc Reid	Fri, 31 Mar 2017 12:48:33 GMT Marc Reid	2
	Deeper Crystal Search Configuration	Dean Ottewell	Thu, 16 Mar 2017 14:15:52 GMT Dean Ottewell	7
	Solvent molecule removel from the crystallographic data	Karlis Berzins	Mon, 20 Feb 2017 17:15:20 GMT Karlis Berzins	0
	Problem with kekulize() of AFUWEE	Anonymous	Mon, 26 Sep 2016 07:49:43 GMT Anonymous	2
	Script to check your structure prior to publication (from 2016 Spring BCA & 2016 ACA meetings)	Paul Sanschagrin	Tue, 26 Jul 2016 23:29:30 GMT Paul Sanschagrin	0
	Changing molecular identifier	Luca Iuzzolino	Fri, 15 Jul 2016 10:06:29 GMT Anthony Reilly	3
	Calculate Miller indices?	Adam Coleman	Mon, 20 Jun 2016 11:50:44 GMT Anthony Reilly	1
	Finding structures that contain two molecules that are different in protonation state only	Marko Rodic	Fri, 16 Oct 2015 11:02:00 GMT Ilenia Giangreco [CCDC Staff]	1
	Script to perform a 'CellCheck' reduced cell search from the currently viewed entry in Mercury	Dave Bardwell [CCDC Staff]	Mon, 20 Jul 2015 11:07:12 GMT Dave Bardwell [CCDC Staff]	0
	Script to generate Mogul data from for a series of compounds	Paul Sanschagrin	Mon, 06 Jul 2015 17:36:47 GMT Paul Sanschagrin	0
	Script to run a CSD similarity search from a .sdf file	Seth Wiggin [CCDC Staff]	Thu, 02 Jul 2015 09:14:46 GMT Seth Wiggin [CCDC Staff]	0

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