Releases · k-ujihara/NCDK

14 Jun 15:28

NCDK-1.3.0a

a5147f5

NCDK-1.3.0

This release is based on https://github.com/cdk/cdk/tree/6fade7b5470669955835046d9fb09c48f658efde snapshot.
Most of features including AtomContainer2 class are implemented and pass tests as Java version.

NuGet packages are uploaded at the followings.
https://www.nuget.org/packages/NCDK/1.3.0
https://www.nuget.org/packages/NCDK.Display/1.3.0

Assets 2

28 Jan 07:06

k-ujihara

NCDK-1.2.0

7aff6e9

NCDK 1.2.0

This release is based on cdk-2.1.0 except AtomContainer2.

NCDKDisplay project is fixed to work well.
MolViewer.exe is a sample program of NCDKDisplay.dll and it contains WPF control to display molecular/reaction.
A lot of member names are changed to C# style.

Assets 3

27 Aug 09:11

k-ujihara

NCDK-1.1.2.2

532df61

NCDK 1.1.2

This release adds ACDK project (A is named after ActiveX).
ACDK is wrapper to access NCDK from VBA.

NCDK-1.1.2.zip --- All binary
ACDK_Installer-1.1.2.msi --- Installer to use NCDK from VBA. Excel example is installed in ACDK folder in my documents.

This release is based on cdk-2.0. The changes from 1.1.2
Rename method name IChemObjectBuilder.Create---(...) to New---()
Rename interface name IAtomContainerSet to IChemObjectSet. Now IAtomContainerSet and AtomContainerSet are non-generic type.
Remove IDescriptor.Initialise method because it is not used.
Change types returned by Descriptors to generic one.
Add wrapper classes for COM interop.

Assets 4

10 Aug 14:40

k-ujihara

NCDK-1.1.1

58023d2

NCDK 1.1.1

This release is still based on CDK-2.0 but built with Visual Studio 2017.
Fixed and refactor some issues.
Updated to InChI version 1 (software version 1.05).
Remove SetReader and SetWriter.

Assets 3