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The Bug Tracker for CDK here at sourceforge.net
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CDK Bug tickets in Aug 2017. Tickets are now
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Showing results of 115

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1211 aromaticity issue with MCS computation cdk-1.4.x open 2012-03-27 2012-11-03 0  
1206 G-M partial charge calculation failing for As None open Miquel Rojas Cherto 2012-02-20 2012-10-08 0  
1204 Various classes are not thread safe None open 2012-02-20 2012-10-08 0  
1195 some descriptors fail to handle aromaticity correctly None open 2011-12-21 2012-10-08 0  
1193 ALOGPDescriptor bug cdk-1.4.x open 2011-12-02 2012-11-03 0  
1192 descriptor name page is broken for 1.5.x master open Egon Willighagen 2011-11-30 2012-10-08 0  
1188 UniversalIsomorphismTester.getOverlaps hangs cdk-1.4.x open 2011-11-04 2012-11-03 0  
1186 indexing in symmetric mcs cdk-1.4.x open Asad 2011-10-31 2013-08-02 0  
1167 CDK Descriptor Calculator GUI (v 1.3.2) Fail None open 2011-07-29 2012-10-08 0  
1164 Atom types with missing information cdk-1.4.x open Egon Willighagen 2011-07-06 2012-11-03 0  
1163 rendering with CompactAtom and Shape.SQUARE is broken cdk-1.4.x open gilleain maclean torrance 2011-07-03 2013-11-10 0  
1161 bond distance lookup failure cdk-1.4.x open 2011-07-02 2013-05-31 0  
1159 Incorrect Charge BCUT Descriptor None open 2011-06-30 2012-10-08 0  
1158 No mass computed for high atomic number elements cdk-1.6.x open Egon Willighagen 2011-06-28 2016-08-11 0  
1142 another phosphor not properly recognized None open Egon Willighagen 2011-06-19 2012-10-08 0  
1139 CDK InChI encapsulation leaks master open 2011-06-10 2012-10-08 0  
1137 Tanimoto score on "raw fingerprint" larger than 1 master open Rajarshi Guha 2011-06-01 2012-10-08 0  
1131 Atom symbols background is always white None open 2011-04-29 2012-10-08 0  
1123 two calls to IChemObjectReader should throw a EOF exception cdk-1.4.x open Egon Willighagen 2011-03-15 2012-11-03 0  
1122 Porphyrin metals not recognised None open gilleain maclean torrance 2011-03-10 2012-10-08 0  
1113 Atom type error for phosphor None open 2010-12-22 2012-10-08 0  
1112 CDK gets nHBDon and nHBAcc wrong for triazole cdk-1.4.x open Christoph Steinbeck 2010-12-09 2012-11-03 0  
1110 GeometryTools has a misleading 'calculate center' method None open Egon Willighagen 2010-11-03 2012-10-08 0  
1109 mol file problem None open Rajarshi Guha 2010-10-26 2012-10-08 0  
1101 Problem generating chiral SMILES jchempaint-primary open 2010-10-06 2012-10-08 0  
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