Ecosyste.ms: Issues
An open API service for providing issue and pull request metadata for open source projects.
GitHub / Actelion/openchemlib issues and pull requests
#93 - get molweight without rounding off
Issue -
State: open - Opened by epbpo over 1 year ago
#92 - SmilesParser is not idempotent
Issue -
State: open - Opened by targos over 1 year ago
#91 - Remove duplicate clone in BaseConformer
Pull Request -
State: closed - Opened by targos over 1 year ago
#90 - refactoring added
Pull Request -
State: closed - Opened by preethakachhadiya over 1 year ago
#89 - Support for Nicknames
Issue -
State: open - Opened by BobHanson over 1 year ago
#88 - CDXML reading
Issue -
State: open - Opened by BobHanson over 1 year ago
- 1 comment
#87 - File drop not implemented?
Issue -
State: open - Opened by BobHanson over 1 year ago
- 2 comments
#86 - proposal for asynchronous compatability with SwingJS
Issue -
State: open - Opened by BobHanson over 1 year ago
- 3 comments
#85 - error in double bond side logic
Issue -
State: closed - Opened by BobHanson over 1 year ago
- 4 comments
#84 - SVGDepictor extends AbstractDepictor<Void>
Issue -
State: closed - Opened by BobHanson over 1 year ago
- 1 comment
#83 - OpenChemLib in Jmol SwingJS - and InChI
Issue -
State: open - Opened by BobHanson over 1 year ago
- 10 comments
#82 - Support for doublet radicals in molfile parser
Issue -
State: closed - Opened by lpatiny over 1 year ago
- 1 comment
#81 - fix DiastereotopicAtomID
Pull Request -
State: closed - Opened by targos almost 2 years ago
- 1 comment
#80 - Change in the unique identifier (oclID)
Issue -
State: closed - Opened by lpatiny almost 2 years ago
- 5 comments
#79 - v3000 problem
Issue -
State: open - Opened by lpatiny almost 2 years ago
- 2 comments
#78 - The functionality of the atoms in the tools panels is inconsistent
Issue -
State: open - Opened by NRayya almost 2 years ago
#77 - Interest in MMFF94 JUnit tests?
Issue -
State: open - Opened by mjw99 about 2 years ago
#76 - Problem with colors
Issue -
State: closed - Opened by lpatiny about 2 years ago
- 3 comments
#75 - SMARTS_MODE_IS_SMILES and 'ABC'
Issue -
State: closed - Opened by lpatiny about 2 years ago
- 2 comments
#74 - Use smile from Maven Central
Pull Request -
State: closed - Opened by mjw99 about 2 years ago
#73 - Fix deps for openjfx for versions greater than JDK11
Pull Request -
State: closed - Opened by mjw99 about 2 years ago
#72 - Issue parsing an organometallic complex SMILES
Issue -
State: open - Opened by felipe-imanishi over 2 years ago
- 3 comments
#71 - Fix for FX testing with Java 8
Pull Request -
State: closed - Opened by mjw99 over 2 years ago
- 1 comment
#70 - Substructure search with wildcard
Issue -
State: open - Opened by c-ruttkies over 2 years ago
- 1 comment
#69 - Add initial Actions CI
Pull Request -
State: closed - Opened by mjw99 over 2 years ago
- 1 comment
#68 - CustomAtomLabels and molfile
Issue -
State: open - Opened by lpatiny over 2 years ago
#67 - addImplicitHydrogens and helpers
Issue -
State: open - Opened by lpatiny over 2 years ago
- 1 comment
#66 - IDCodeParser(true) and coordinates
Issue -
State: open - Opened by lpatiny almost 3 years ago
- 1 comment
#65 - addImplicitHydrogens of N
Issue -
State: closed - Opened by lpatiny about 3 years ago
#64 - Build error
Issue -
State: open - Opened by giraudisa over 3 years ago
- 1 comment
#63 - Speed problem in openchemlib-js
Issue -
State: open - Opened by lpatiny over 3 years ago
- 4 comments
#62 - Bump junit from 4.9 to 4.13.1
Pull Request -
State: closed - Opened by dependabot[bot] almost 4 years ago
Labels: dependencies
#61 - Different IDCodes for SMILES and MDL MOL
Issue -
State: closed - Opened by c-ruttkies almost 4 years ago
- 2 comments
#60 - Discrepancies in logS prediction
Issue -
State: closed - Opened by c-ruttkies about 4 years ago
- 4 comments
#59 - Mol to SMARTS
Issue -
State: closed - Opened by c-ruttkies over 4 years ago
- 4 comments
#58 - Wrong mapping with copyMoleculeByAtoms
Issue -
State: open - Opened by lpatiny over 4 years ago
- 2 comments
#57 - Hydrogens are not copied when using `copyMoleculeByAtoms`
Issue -
State: open - Opened by lpatiny over 4 years ago
#56 - getPath reorder the atoms !
Issue -
State: closed - Opened by lpatiny over 4 years ago
- 1 comment
#55 - Library description needed
Issue -
State: closed - Opened by merkys about 5 years ago
- 2 comments
#54 - Stereochemistry and custom atom labels
Issue -
State: open - Opened by lpatiny about 5 years ago
- 1 comment
#53 - Bug in helpers ?
Issue -
State: open - Opened by lpatiny about 5 years ago
- 1 comment
#52 - Rendering of custom labels with special isotopes
Issue -
State: closed - Opened by lpatiny about 5 years ago
- 2 comments
#51 - Java source/target version 1.8 is required instead of the declared 1.6
Issue -
State: closed - Opened by vaitkus about 5 years ago
- 2 comments
#50 - Problem with SVG
Issue -
State: open - Opened by lpatiny about 5 years ago
#49 - Conformation generation and symmetry
Issue -
State: open - Opened by lpatiny about 5 years ago
- 1 comment
#48 - Cyclohexane and twisted boat conformation
Issue -
State: open - Opened by lpatiny about 5 years ago
#47 - Adding missing dependencies on javafx.*
Pull Request -
State: closed - Opened by merkys about 5 years ago
- 1 comment
#46 - Renaming some methods in ConformerGenerator ?
Issue -
State: closed - Opened by lpatiny about 5 years ago
- 4 comments
#45 - CLogPPredictor seems broken
Issue -
State: closed - Opened by targos over 5 years ago
- 3 comments
#44 - SVG generation and ID of bonds
Issue -
State: closed - Opened by lpatiny over 5 years ago
- 2 comments
#43 - Converting to InChI
Issue -
State: closed - Opened by frank-rollpin over 5 years ago
- 1 comment
#42 - Substructure search with query feature on bonds
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 2 comments
#41 - Pull requests and branch merge
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 2 comments
#40 - ring bond query feature
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 11 comments
#39 - Depiction of isotopes
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 1 comment
#38 - Axial chirality
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 2 comments
#37 - What is the best format to store and reload reactions ?
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 4 comments
#36 - fix(depictor): fillCircle receives diameter instead of radius
Pull Request -
State: closed - Opened by targos almost 6 years ago
- 2 comments
#35 - isomeric SMILES does not match Daylight's examples
Issue -
State: closed - Opened by targos almost 6 years ago
- 2 comments
#34 - Best way to implement reaction editor
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 1 comment
#33 - SMARTS Conversion to MOL removes mapping for hydrogen
Issue -
State: open - Opened by Artoria2e5 almost 6 years ago
- 1 comment
#32 - Coordinates change after parsing
Issue -
State: closed - Opened by targos almost 6 years ago
- 3 comments
#31 - joining 2 molfiles
Issue -
State: closed - Opened by lpatiny almost 6 years ago
- 2 comments
#30 - Errors in interpretation of tetrahedral stereo in SMILES strings involving distant bond closure digit
Issue -
State: closed - Opened by baoilleach about 6 years ago
- 2 comments
#29 - Errors in interpretation of cis/trans stereo in SMILES strings
Issue -
State: closed - Opened by baoilleach about 6 years ago
#28 - Incorrect order (?) of ring closure digits when writing SMILES
Issue -
State: closed - Opened by baoilleach over 6 years ago
- 1 comment
#27 - Generation of an aromatic SMILES with cis/trans bond but no double bond
Issue -
State: closed - Opened by baoilleach over 6 years ago
- 1 comment
#26 - New kekulization failures between 2017.09.0 and 2018.5.0
Issue -
State: closed - Opened by baoilleach over 6 years ago
- 2 comments
#25 - Change in behaviour of SmilesParser
Issue -
State: closed - Opened by baoilleach over 6 years ago
- 3 comments
#24 - License of BitUtils.java is unclear
Issue -
State: closed - Opened by merkys over 6 years ago
- 3 comments
#23 - Disagreements with SMILES valence model when reading SMILES
Issue -
State: closed - Opened by baoilleach about 7 years ago
- 4 comments
#22 - [se]1cccc1 not read (kekulization failure)
Issue -
State: closed - Opened by baoilleach about 7 years ago
- 1 comment
#21 - Hydrogen missing when reading SMILES
Issue -
State: closed - Opened by baoilleach about 7 years ago
- 1 comment
#20 - Question: Possible to generate aromatic SMILES?
Issue -
State: closed - Opened by baoilleach about 7 years ago
- 2 comments
#19 - Malformed output MOL V2000 files
Issue -
State: closed - Opened by vaitkus about 7 years ago
- 2 comments
#18 - CanonizerMesoHelper
Issue -
State: closed - Opened by andcastillo about 7 years ago
- 2 comments
#17 - Fix valence problem with diastereoID of heavy atom
Pull Request -
State: closed - Opened by lpatiny about 7 years ago
- 1 comment
#16 - SVG redering of NaH
Issue -
State: closed - Opened by lpatiny over 7 years ago
- 2 comments
#15 - error during parsing Smile
Issue -
State: closed - Opened by thegodone over 7 years ago
- 3 comments
#14 - SVG rendering of empty molecule has wrong dimensions
Issue -
State: open - Opened by stropitek over 7 years ago
#13 - Bond width smaller than 1 -> 0
Issue -
State: closed - Opened by lpatiny over 7 years ago
- 1 comment
#12 - Angle in bonds
Issue -
State: closed - Opened by lpatiny almost 8 years ago
- 1 comment
#11 - fragment rendering of OH
Issue -
State: closed - Opened by lpatiny almost 8 years ago
- 2 comments
#10 - copyOf prevents GWT compilation
Issue -
State: closed - Opened by lpatiny almost 8 years ago
- 2 comments
#9 - no coordinates molfiles are not depicted anymore
Issue -
State: closed - Opened by lpatiny almost 8 years ago
- 3 comments
#8 - addImplicitsHydrogens
Issue -
State: closed - Opened by lpatiny about 8 years ago
- 2 comments
#7 - Obtaining version or build information?
Issue -
State: closed - Opened by tdudgeon about 8 years ago
- 4 comments
#6 - SSSearch Usage
Issue -
State: closed - Opened by johnmay over 8 years ago
- 3 comments
#5 - Maven repo
Issue -
State: closed - Opened by tdudgeon over 8 years ago
- 4 comments
#4 - Molecule: setFragment is not invertible
Issue -
State: closed - Opened by targos almost 9 years ago
- 2 comments
#3 - Classes for hoo4
Pull Request -
State: closed - Opened by andcastillo almost 9 years ago
#2 - Packaging problems
Issue -
State: closed - Opened by andcastillo almost 9 years ago
- 1 comment
#1 - Remove java classes from dd_share
Issue -
State: closed - Opened by rufenerc over 9 years ago