Indigo.Net 1.4.0-beta.12

This is a prerelease version of Indigo.Net.
There is a newer version of this package available.
See the version list below for details.
dotnet add package Indigo.Net --version 1.4.0-beta.12
NuGet\Install-Package Indigo.Net -Version 1.4.0-beta.12
This command is intended to be used within the Package Manager Console in Visual Studio, as it uses the NuGet module's version of Install-Package.
<PackageReference Include="Indigo.Net" Version="1.4.0-beta.12" />
For projects that support PackageReference, copy this XML node into the project file to reference the package.
paket add Indigo.Net --version 1.4.0-beta.12
#r "nuget: Indigo.Net, 1.4.0-beta.12"
#r directive can be used in F# Interactive and Polyglot Notebooks. Copy this into the interactive tool or source code of the script to reference the package.
// Install Indigo.Net as a Cake Addin
#addin nuget:?package=Indigo.Net&version=1.4.0-beta.12&prerelease

// Install Indigo.Net as a Cake Tool
#tool nuget:?package=Indigo.Net&version=1.4.0-beta.12&prerelease

Build Status Build Status License

EPAM Indigo projects

Copyright (c) 2009 to present EPAM Systems Apache License version 2.0

Introduction

This repository includes:

  • Bingo: Chemistry search engine for Oracle, Microsoft SQL Server and PostgreSQL databases
  • Indigo: Universal cheminformatics library with bindings to .NET, Java and Python, and the following tools:
  • Legio: GUI application for combinatorial chemistry
  • ChemDiff: Visual comparison of two SDF or SMILES files
  • indigo-depict: Molecule and reaction rendering utility
  • indigo-cano: Canonical SMILES generator
  • indigo-deco: R-Group deconvolution utility

Detailed documentation is available at http://lifescience.opensource.epam.com

Download

https://lifescience.opensource.epam.com/download/indigo/index.html

Bindings:

Source code organization

Main directory structure layout:

  • api: Indigo API sources
  • bingo: Bingo sources
  • build_scripts: CMake and python scripts for building all the sources
  • third_party: sources for third-party libraries
  • utils: utilities sources
  • common|graph|layout|molecule|reaction|render2d: indigo-core sources

Each project is placed in the corresponding directory with CMakeList.txt configuration file, that does not include other projects. In order to build the whole project with the correct references you need to use CMake configurations from the build_scripts directory.

Build instructions

All the CMake projects are placed in build_scripts directories. You can use them manually, or execute preconfigured scripts that does all the job.

Bingo build instructions

To generate project configuration, build the source code, and create the archives for installation you need to execute build_scripts/bingo-release.py:

python build_scripts/bingo-release.py --preset=linux32 --dbms=[postgres|oracle|sqlserver]

The are different cmake presets: linux32, linux64, win32, win64, mac10.7 (and also all later mac10.x versions)

Indigo build instructions

To generate project configuration, build the source code, and create the archives for installation you need to execute build_scripts/indigo-release-libs.py and build_scripts/indigo-release-utils.py:

Linux (GCC 4.9+ or Clang 3.5+)

APT-based requirements (Debian or Ubuntu):

sudo apt install cmake libfreetype6-dev libfontconfig1-dev

RPM-based requirements (RedHat, CentOS, Fedora): install Developer Toolset if your OS does not have GCC 4.9+ and then install dependencies:

sudo yum install cmake freetype-devel fontconfig-devel

Build libraries and utils:

python build_scripts/indigo-release-libs.py --preset=linux64
python build_scripts/indigo-release-utils.py --preset=linux64

Windows (Microsoft Visual Studio 2013+ or MinGW with GCC version 4.9+)

python build_scripts/indigo-release-libs.py --preset=win64-2013
python build_scripts/indigo-release-utils.py --preset=win64-2013

Mac OS (Clang 3.5+)

python build_scripts/indigo-release-libs.py --preset=mac10.14
python build_scripts/indigo-release-utils.py --preset=mac10.14

Other

There are different cmake presets:

  • win32-2013, win64-2013: Visual Studio 2013
  • win32-2015, win64-2015: Visual Studio 2015
  • win32-2017, win64-2017: Visual Studio 2017
  • win32-2019, win64-2019: Visual Studio 2019
  • win32-mingw: MinGW
  • win64-mingw: MinGW-w64
  • linux32, linux64: GCC or Clang on Linux with C++11 support
  • linux32-universal, linux64-universal: GCC on Linux with statically linked libstdc++ for using on older Linux systems without C++11 support
  • mac10.7, mac10.8, mac10.9, mac10.10, mac10.11, mac10.12, mac10.12, mac10.13, mac10.14, mac10.15: target Mac OS X or macOS
  • mac-universal: targeting Mac OS X 10.7 as first version with C++11 support, should work on all Mac OS X 10.7+ systems

Wrappers

To generate Java, C#, or Python wrappers after build the binaries you need to execute

python build_scripts/indigo-make-by-libs.py --type=java

Available types: java, dotnet, python

Product Compatible and additional computed target framework versions.
.NET net5.0 was computed.  net5.0-windows was computed.  net6.0 was computed.  net6.0-android was computed.  net6.0-ios was computed.  net6.0-maccatalyst was computed.  net6.0-macos was computed.  net6.0-tvos was computed.  net6.0-windows was computed.  net7.0 was computed.  net7.0-android was computed.  net7.0-ios was computed.  net7.0-maccatalyst was computed.  net7.0-macos was computed.  net7.0-tvos was computed.  net7.0-windows was computed.  net8.0 was computed.  net8.0-android was computed.  net8.0-browser was computed.  net8.0-ios was computed.  net8.0-maccatalyst was computed.  net8.0-macos was computed.  net8.0-tvos was computed.  net8.0-windows was computed. 
.NET Core netcoreapp2.0 was computed.  netcoreapp2.1 was computed.  netcoreapp2.2 was computed.  netcoreapp3.0 was computed.  netcoreapp3.1 was computed. 
.NET Standard netstandard2.0 is compatible.  netstandard2.1 was computed. 
.NET Framework net461 was computed.  net462 was computed.  net463 was computed.  net47 was computed.  net471 was computed.  net472 was computed.  net48 was computed.  net481 was computed. 
MonoAndroid monoandroid was computed. 
MonoMac monomac was computed. 
MonoTouch monotouch was computed. 
Tizen tizen40 was computed.  tizen60 was computed. 
Xamarin.iOS xamarinios was computed. 
Xamarin.Mac xamarinmac was computed. 
Xamarin.TVOS xamarintvos was computed. 
Xamarin.WatchOS xamarinwatchos was computed. 
Compatible target framework(s)
Included target framework(s) (in package)
Learn more about Target Frameworks and .NET Standard.

NuGet packages (2)

Showing the top 2 NuGet packages that depend on Indigo.Net:

Package Downloads
Sds.SdfParser

Sdf file reader

Sds.CdxParser

CDX file reader

GitHub repositories

This package is not used by any popular GitHub repositories.

Version Downloads Last updated
1.21.0-dev.2 77 4/22/2024
1.20.0-rc.1 74 4/15/2024
1.20.0-dev.1 61 3/15/2024
1.19.0-rc.3 62 4/2/2024
1.19.0-rc.2 66 3/22/2024
1.19.0-rc.1 76 3/14/2024
1.19.0-dev.1 79 3/7/2024
1.18.0 791 2/29/2024
1.18.0-rc.9 89 2/27/2024
1.18.0-rc.8 119 2/22/2024
1.18.0-rc.7 107 2/13/2024
1.18.0-rc.6 55 2/5/2024
1.18.0-rc.5 64 1/26/2024
1.18.0-rc.4 55 1/22/2024
1.18.0-rc.3 62 1/16/2024
1.18.0-rc.2 58 1/16/2024
1.18.0-rc.1 62 1/12/2024
1.18.0-dev.5 48 2/2/2024
1.18.0-dev.4 87 1/11/2024
1.18.0-dev.3 84 1/8/2024
1.18.0-dev.2 99 1/3/2024
1.18.0-dev.1 140 12/16/2023
1.17.0 142 2/29/2024
1.17.0-rc.3 91 12/18/2023
1.17.0-rc.2 109 12/11/2023
1.17.0-rc.1 121 12/8/2023
1.16.0 172 1/29/2024
1.16.0-rc.3 102 12/13/2023
1.16.0-rc.2 135 11/24/2023
1.16.0-rc.1 92 11/9/2023
1.15.0-rc.2 125 10/30/2023
1.15.0-rc.1 108 10/23/2023
1.15.0-dev.5 72 10/23/2023
1.15.0-dev.4 116 10/19/2023
1.15.0-dev.3 112 10/17/2023
1.15.0-dev.2 103 10/16/2023
1.15.0-dev.1 100 10/12/2023
1.14.0 1,141 11/2/2023
1.14.0-rc.7 80 10/20/2023
1.14.0-rc.6 115 10/10/2023
1.14.0-rc.5 122 9/12/2023
1.14.0-rc.4 124 8/29/2023
1.14.0-rc.3 106 8/25/2023
1.14.0-rc.2 127 8/21/2023
1.14.0-rc.1 140 8/11/2023
1.13.0 363 9/27/2023
1.13.0-rc.1 137 7/18/2023
1.12.0 4,943 7/9/2023
1.12.0-rc.2 132 6/2/2023
1.12.0-rc.1 90 5/23/2023
1.11.0 347 6/7/2023
1.11.0-rc.1 139 4/18/2023
1.10.0 3,258 3/20/2023
1.10.0-rc.6 182 3/20/2023
1.10.0-rc.5 203 3/17/2023
1.10.0-rc.4 153 2/21/2023
1.10.0-rc.3 121 2/15/2023
1.10.0-rc.2 206 1/30/2023
1.10.0-rc.1 146 1/30/2023
1.9.0 564 1/30/2023
1.9.0-rc.4 138 1/17/2023
1.9.0-rc.3 116 1/13/2023
1.9.0-rc.2 115 12/26/2022
1.8.3 3,282 11/30/2022
1.8.2 493 11/25/2022
1.8.1 493 11/15/2022
1.8.0 532 11/3/2022
1.8.0-rc.2 120 10/20/2022
1.8.0-rc.1 106 10/14/2022
1.7.4 1,447 6/20/2022
1.7.3 626 6/17/2022
1.7.2 583 6/16/2022
1.7.0 1,269 5/26/2022
1.7.0-beta 278 5/19/2022
1.6.1 761 12/29/2021
1.5.0 589 8/30/2021
1.4.3 10,815 12/29/2020
1.4.2 502 12/28/2020
1.4.1 658 11/25/2020
1.4.0-rc1 299 11/25/2020
1.4.0-beta.12 1,574 4/20/2020
1.4.0-beta 2,794 10/11/2019
1.3.0-beta 929 12/30/2016
1.2.3 3,344 5/18/2016
1.2.1 1,658 5/7/2015
1.1.12 1,353 4/6/2015
1.0.0 1,238 4/11/2015