Skip to content
Permalink

Comparing changes

Choose two branches to see what’s changed or to start a new pull request. If you need to, you can also or learn more about diff comparisons.

Open a pull request

Create a new pull request by comparing changes across two branches. If you need to, you can also . Learn more about diff comparisons here.
base repository: cdk/cdk
base: 420b4c8d205c
Choose a base ref
...
head repository: cdk/cdk
compare: 57fdafaac4ee
Choose a head ref
  • 8 commits
  • 11 files changed
  • 1 contributor

Commits on Jan 19, 2014

  1. We will use a single test class for test multiple predicates. 

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    fba130e View commit details
    Browse the repository at this point in the history

  2. Filter sub-structure matches for those with unique bond mapping. 

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    2fb07f5 View commit details
    Browse the repository at this point in the history

  3. A fluent interface to structure search matches. 

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    b152a4a View commit details
    Browse the repository at this point in the history

  4. Pattern now returns a mapping - note as mapping is still an Iterable<… 

    …int[]> no existing usages need to be updated.

Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    d4f5925 View commit details
    Browse the repository at this point in the history

  5. UniqueAtomMatches is now exposed through the Mappings interface rathe… 

    …r than the public API.

Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    be4790c View commit details
    Browse the repository at this point in the history

  6. Only check stereochemistry when returning a single match or testing w… 

    …ith 'matches' but not 'matchAll'. This is now documented in the Pattern API.

Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    2ae088c View commit details
    Browse the repository at this point in the history

  7. Provide a default search, VentoFoggia, in the pattern API. 

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    0e24796 View commit details
    Browse the repository at this point in the history

  8. Testing the new fluent Mappings utility. 

    Signed-off-by: Egon Willighagen <egonw@users.sourceforge.net>
    @johnmay @egonw
    johnmay authored and egonw committed Jan 19, 2014
    Copy the full SHA
    57fdafa View commit details
    Browse the repository at this point in the history