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Actelion
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openchemlib
Open source Java-based chemistry library
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Added extension to DWARFileParser (getRawData)
#113
lithom
closed
1 week ago
0
No change in idCode when unknown chirality ?
#112
lpatiny
closed
2 months ago
1
Extra space in RXN v3 ?
#111
lpatiny
closed
2 months ago
2
Small issue with highlight
#110
lpatiny
opened
2 months ago
0
set tool before redrawing when tool is changed
#109
targos
closed
2 months ago
0
remove reference to Swing in generic editor
#108
targos
closed
2 months ago
0
New smiles parser do not through if unknown element
#107
lpatiny
closed
2 months ago
1
Remove atoms in 2 atoms molecule
#106
lpatiny
closed
2 months ago
2
Out Of Bounds Exception
#105
r0754329
closed
5 months ago
6
Structure editor number of ring bond constraints for ring atoms
#104
lithom
closed
5 months ago
1
Scaling of Labels and Lines in Structure Editor
#103
lithom
closed
5 months ago
2
SMARTS parsing bug
#102
OliverBScott
closed
5 months ago
1
Bug in reaction automapper leads to infinite loop
#101
lithom
opened
11 months ago
0
Possible bug when reading SMARTS strings.
#100
OliverBScott
closed
1 year ago
4
Delete and recreate the build directory on each run
#99
vaitkus
closed
1 year ago
0
Installing version openchemlib-2021.8.2
#98
and-tos
closed
1 year ago
2
Bug in copyMoleculeByAtoms when H are mapped
#97
lpatiny
opened
1 year ago
1
Inconsistencies in symmetryRank ?
#96
lpatiny
closed
1 year ago
1
Is the source code for actelionclip library available?
#95
mjw99
opened
1 year ago
2
Extend metal atom set
#94
vaitkus
closed
1 year ago
0
get molweight without rounding off
#93
epbpo
opened
1 year ago
1
SmilesParser is not idempotent
#92
targos
closed
5 months ago
3
Remove duplicate clone in BaseConformer
#91
targos
closed
1 year ago
0
refactoring added
#90
preethakachhadiya
closed
1 year ago
0
Support for Nicknames
#89
BobHanson
opened
1 year ago
0
CDXML reading
#88
BobHanson
opened
1 year ago
1
File drop not implemented?
#87
BobHanson
opened
1 year ago
2
proposal for asynchronous compatability with SwingJS
#86
BobHanson
opened
1 year ago
3
error in double bond side logic
#85
BobHanson
closed
1 year ago
4
SVGDepictor extends AbstractDepictor<Void>
#84
BobHanson
closed
1 year ago
1
OpenChemLib in Jmol SwingJS - and InChI
#83
BobHanson
opened
1 year ago
10
Support for doublet radicals in molfile parser
#82
lpatiny
closed
1 year ago
1
fix DiastereotopicAtomID
#81
targos
closed
1 year ago
1
Change in the unique identifier (oclID)
#80
lpatiny
closed
1 year ago
5
v3000 problem
#79
lpatiny
opened
1 year ago
2
The functionality of the atoms in the tools panels is inconsistent
#78
NRayya
opened
1 year ago
0
Interest in MMFF94 JUnit tests?
#77
mjw99
opened
2 years ago
0
Problem with colors
#76
lpatiny
closed
2 years ago
3
SMARTS_MODE_IS_SMILES and 'ABC'
#75
lpatiny
closed
2 years ago
2
Use smile from Maven Central
#74
mjw99
closed
2 years ago
0
Fix deps for openjfx for versions greater than JDK11
#73
mjw99
closed
2 years ago
0
Issue parsing an organometallic complex SMILES
#72
felipe-imanishi
closed
5 months ago
4
Fix for FX testing with Java 8
#71
mjw99
closed
2 years ago
1
Substructure search with wildcard
#70
c-ruttkies
opened
2 years ago
1
Add initial Actions CI
#69
mjw99
closed
2 years ago
1
CustomAtomLabels and molfile
#68
lpatiny
opened
2 years ago
0
addImplicitHydrogens and helpers
#67
lpatiny
opened
2 years ago
1
IDCodeParser(true) and coordinates
#66
lpatiny
opened
3 years ago
1
addImplicitHydrogens of N
#65
lpatiny
closed
3 years ago
0
Build error
#64
giraudisa
opened
3 years ago
1
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