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pdbe
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pdbe
Issues

Open 20
Closed 43
All 63

Priority Created date Updated date Milestone due date Due date Popularity Label priority Manual Title Weight Blocking

Use RDKit to write sdf file for PDB CCD 4 of 4 tasks completed

ccdutils#3 · created May 29, 2017 by Oliver Smart Improve PDBe Chemical Components backend infrastructure using RDKit: beta test version Qi project development
- CLOSED
- 5
updated Mar 28, 2018
Initial version of class to create RDKit molecule from a PDB CCD definition

ccdutils#2 · created May 29, 2017 by Oliver Smart Improve PDBe Chemical Components backend infrastructure using RDKit: beta test version development
- CLOSED
- 1
updated May 29, 2017
Class to parse PDB chemical component cif definitions: initial version

ccdutils#1 · created May 29, 2017 by Oliver Smart Improve PDBe Chemical Components backend infrastructure using RDKit: beta test version development
- CLOSED
- 1
updated Mar 28, 2018

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