Discovery - The Cambridge Crystallographic Data Centre (CCDC)

	Thread	Author	Last Post	Replies
	distance constraint from fixed cofactor to substrate (ligand to be docked)	Anonymous	Tue, 29 Dec 2020 11:52:20 GMT Anonymous	16
	Invalid scores when setting distance constraint from cofactor to substrate, ligand to be docked	Anonymous	Mon, 15 Jul 2019 17:58:20 GMT Anonymous	5
	GoldMine functions using the CSD API GOLD Goldmine	Jordan McCone	Fri, 27 Nov 2020 06:45:07 GMT Anonymous	6
	Script to merge GOLD docking results	Paul Sanschagrin	Tue, 26 Feb 2019 09:12:20 GMT Richard Sykes [CCDC Staff]	2
	Renumbering Atoms in mol2 files to create specific constraints for GOLD Docking	Suliman Sharif	Sat, 22 Apr 2017 05:43:31 GMT Suliman Sharif	0
	Script to compare protein bound ligand conformations to CSD Conformer	Alicia Higueruelo	Fri, 11 Dec 2015 14:06:23 GMT Alicia Higueruelo	1
	Script to filter molecular conformers with unusual torsion angles	Paul Sanschagrin	Mon, 06 Jul 2015 14:04:43 GMT Paul Sanschagrin	0
	Script to extract unique rings of a specified size from the CSD	Christin Schaerfer	Mon, 06 Jul 2015 10:52:42 GMT Christin Schaerfer	0

You must be signed in to post in this forum.