Materials - The Cambridge Crystallographic Data Centre (CCDC)

	Thread	Author	Last Post	Replies
	Hydrogen Bond Propensity calculations with Python 3	Andrew Maloney [CCDC Staff]	Tue, 21 Jul 2020 19:20:17 GMT Philip Bransford	13
	Convert multiple mol2 files into one concatenated multi-mol2 file	Ioana Sovago [CCDC Staff]	Tue, 14 Jul 2020 13:19:15 GMT Ioana Sovago [CCDC Staff]	0
	BFDH Morphology - different results in Mercury and CSD Python API Mercury CSD	Anonymous	Tue, 10 Mar 2020 14:22:24 GMT Anonymous	0
	searching for likely interactions with a fragment Mercury ConQuest	Martin Ward	Thu, 30 Jan 2020 10:47:41 GMT Martin Ward	0
	packing similarity output	Anonymous	Thu, 16 Jan 2020 10:13:14 GMT Anonymous	3
	Script to run a multi-component Hydrogen Bond Propensity calculation	Andrew Maloney [CCDC Staff]	Fri, 01 Nov 2019 15:34:18 GMT Anonymous	7
	Topology analysis using the python code	Anonymous	Thu, 30 May 2019 16:19:04 GMT Andrew Maloney [CCDC Staff]	1
	Finding distance between two planes	Louise Price	Thu, 16 May 2019 15:15:08 GMT Richard Sykes [CCDC Staff]	5
	BFDH Morphology Mercury	Vijay Srirambhatla	Thu, 25 Apr 2019 14:38:54 GMT Richard Sykes [CCDC Staff]	4
	Co-crystal design	Luca Iuzzolino	Thu, 18 Apr 2019 10:19:32 GMT Luca Iuzzolino	4
	Script to run a single Hydrogen Bond Propensity calculation		Tue, 04 Dec 2018 12:48:34 GMT Andrew Maloney [CCDC Staff]	1
	Countercation of 1,2-ethylenediamine (H2en) at special position CSD	Mao-Long Chen	Thu, 30 Aug 2018 09:15:10 GMT Seth Wiggin [CCDC Staff]	3
	Scripts from Chemistry of Materials perspective for analysis of the CSD MOF subset	Seth Wiggin [CCDC Staff]	Thu, 08 Jun 2017 13:42:54 GMT Seth Wiggin [CCDC Staff]	2
	Packing Similarity Dendrogram	Anthony Reilly	Fri, 09 Dec 2016 11:18:05 GMT Anthony Reilly	1
	Inverting a molecule	Luca Iuzzolino	Thu, 14 Apr 2016 15:37:17 GMT Luca Iuzzolino	2
	Void space in crystal structures	Peter Wood [CCDC Staff]	Wed, 22 Jul 2015 09:47:48 GMT Peter Wood [CCDC Staff]	5

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