Skip to content
Navigation Menu
Sign in
Appearance settings
Platform
AI CODE CREATION
GitHub Copilot
Write better code with AI
GitHub Copilot app
Direct agents from issue to merge
MCP Registry
Integrate external tools
DEVELOPER WORKFLOWS
Actions
Automate any workflow
Codespaces
Instant dev environments
Issues
Plan and track work
Code Review
Manage code changes
Code Quality
Enforce quality at merge
APPLICATION SECURITY
GitHub Advanced Security
Find and fix vulnerabilities
Code security
Secure your code as you build
Secret protection
Stop leaks before they start
EXPLORE
Why GitHub
Documentation
Blog
Changelog
Marketplace
View all features
Solutions
BY COMPANY SIZE
Enterprises
Small and medium teams
Startups
Nonprofits
BY USE CASE
App Modernization
DevSecOps
DevOps
CI/CD
View all use cases
BY INDUSTRY
Healthcare
Financial services
Manufacturing
Government
View all industries
View all solutions
Resources
EXPLORE BY TOPIC
AI
Software Development
DevOps
Security
View all topics
EXPLORE BY TYPE
Customer stories
Events & webinars
Ebooks & reports
Business insights
GitHub Skills
SUPPORT & SERVICES
Documentation
Customer support
Community forum
Trust center
Partners
View all resources
Open Source
COMMUNITY
GitHub Sponsors
Fund open source developers
PROGRAMS
Security Lab
Maintainer Community
Accelerator
GitHub Stars
Archive Program
REPOSITORIES
Topics
Trending
Collections
Enterprise
ENTERPRISE SOLUTIONS
Enterprise platform
AI-powered developer platform
AVAILABLE ADD-ONS
GitHub Advanced Security
Enterprise-grade security features
Copilot for Business
Enterprise-grade AI features
Premium Support
Enterprise-grade 24/7 support
Pricing
Type
/
to search
Sign in
Sign up
Appearance settings
You signed in with another tab or window.
Reload
to refresh your session.
You signed out in another tab or window.
Reload
to refresh your session.
You switched accounts on another tab or window.
Reload
to refresh your session.
Dismiss alert
{{ message }}
Uh oh!
There was an error while loading.
Please reload this page
.
cdk
/
chemojava
Public
Notifications
You must be signed in to change notification settings
Fork
1
Star
1
Code
Issues
1
Pull requests
1
Actions
Projects
Security and quality
0
Insights
Additional navigation options
Code
Issues
Pull requests
Actions
Projects
Security and quality
Insights
Commits
Branch selector
main
User selector
All users
All time
Commit history
Commits on Apr 3, 2026
Create LICENSE.md
egonw
authored
cadec16
View commit details
Copy full SHA for cadec16
Browse repository at this point
Commits on Jun 8, 2025
Converted to Markdown
egonw
authored
953093c
View commit details
Copy full SHA for 953093c
Browse repository at this point
Commits on Oct 13, 2018
Typo fix.
egonw
authored
4f9d7ab
View commit details
Copy full SHA for 4f9d7ab
Browse repository at this point
Commits on Sep 17, 2011
Bumped version number to follow the CDK dependency
egonw
committed
71f4a54
View commit details
Copy full SHA for 71f4a54
Browse repository at this point
Removed the calling of build.xml
egonw
committed
a8f4769
View commit details
Copy full SHA for a8f4769
Browse repository at this point
Added the jars needed for the QSAR model code
egonw
committed
1f8377b
View commit details
Copy full SHA for 1f8377b
Browse repository at this point
Added the R-based model package and associated jar files and test code,
Show description for 0c581cc
egonw
committed
0c581cc
View commit details
Copy full SHA for 0c581cc
Browse repository at this point
Also ignore the autogenerated build/
egonw
committed
9018b31
View commit details
Copy full SHA for 9018b31
Browse repository at this point
Ant 1.8 does fine too
egonw
committed
0a36c0e
View commit details
Copy full SHA for 0a36c0e
Browse repository at this point
Updated to current state
egonw
committed
6fd4775
View commit details
Copy full SHA for 6fd4775
Browse repository at this point
Ignore the autogenerated bin/ dir
egonw
committed
99c4328
View commit details
Copy full SHA for 99c4328
Browse repository at this point
Upgraded to CDK 1.4.2 jars
egonw
committed
989846b
View commit details
Copy full SHA for 989846b
Browse repository at this point
Commits on May 13, 2009
Updated Weka to read from an InputStream which will solve loading data files in an Eclipse environment where the Weka class may not have the used data files in the classpath
Show description for 3c5b337
egon.willighagen
committed
3c5b337
View commit details
Copy full SHA for 3c5b337
Browse repository at this point
Cleaned up to make it use JUnit4
Show description for 56e1d04
egon.willighagen
committed
56e1d04
View commit details
Copy full SHA for 56e1d04
Browse repository at this point
Commits on May 12, 2009
Reworked to use CDK module jars, so that I can use cdk-eclipse to make Eclipse bundles
Show description for 102ca33
egon.willighagen
committed
102ca33
View commit details
Copy full SHA for 102ca33
Browse repository at this point
Compiled against CDK 1.2.2
Show description for 78d5eaa
egon.willighagen
committed
78d5eaa
View commit details
Copy full SHA for 78d5eaa
Browse repository at this point
Commits on Aug 13, 2008
Renamed package names to org.openscience.chemojava
Show description for da03d9d
egon.willighagen
committed
da03d9d
View commit details
Copy full SHA for da03d9d
Browse repository at this point
Commits on Aug 7, 2008
Added two missing files
Show description for 57c8617
egon.willighagen
committed
57c8617
View commit details
Copy full SHA for 57c8617
Browse repository at this point
Copy from CDK SVN https://cdk.svn.sourceforge.net/svnroot/cdk/cdk-gpl/trunk@11961
Show description for 2b009e4
egon.willighagen
committed
2b009e4
View commit details
Copy full SHA for 2b009e4
Browse repository at this point
Commits on Aug 6, 2008
Initial directory structure.
Show description for 240352f
(no author)
committed
240352f
View commit details
Copy full SHA for 240352f
Browse repository at this point
You can’t perform that action at this time.
egon.willighagen