Anaconda 5.2 Install For Mac

Citrix receiver for mac ipad 4. Anaconda2-5.2.0-Linux-x86_64.sh, 603.4M, 2018-05-30 13:04:33. Anaconda-2.3.0-Windows-x86_64.exe, 334.7M, 2015-07-01 13:35:10. You can install Anaconda using either the graphical installer (“wizard”) or the command. Download the graphical macOS installer for your version of Python.

Building from Source Starting with the 2018_03 release, the RDKit core C++ code is written in modern C++; for this release that means C++11. This means that the compilers used to build it cannot be completely ancient. Here are the minimum tested versions: • g++ v4.8: though note that the SLN parser code cannot be built with v4.8.

It will automatically be disabled when this older compiler is used. • clang v3.9: it may be that older versions of the compiler also work, but we haven’t tested them. • Visual Studio 2015: it may be that older versions of the compiler also work, but we haven’t tested them. Installing prerequisites from source • Required packages: • cmake. You need version 3.1 (or more recent).

If your linux distribution doesn’t have an appropriate package. • The following are required if you are planning on using the Python wrappers • The python headers. This probably means that you need to install the python-dev package (or whatever it’s called) for your linux distribution.

You also need the shared libraries. This may require that you install a sqlite3-dev package. • You need to have numpy (installed. Note if you do have a version of the boost libraries pre-installed and you want to use your own version, be careful when you build the code. We’ve seen at least one example on a Fedora system where cmake compiled using a user-installed version of boost and then linked against the system version. This led to segmentation faults. There is a workaround for this below in the (see FAQ) section.

• download the boost source distribution from • extract the source somewhere on your machine (e.g. /usr/local/src/boost_1_58_0) • build the required boost libraries. The boost site has for this, but here’s an overview: • cd $BOOST • If you want to use the python wrappers:./bootstrap.sh --with-libraries=python,serialization • If not using the python wrappers:./bootstrap.sh --with-libraries=serialization •./b2 install.

Wget https: // github. Com / rdkit / rdkit / archive / Release_XXXX_XX_X. Gz • Ensure that the prerequisites are installed • environment variables: • RDBASE: the root directory of the RDKit distribution (e.g. Recommended extras • You can enable support for generating InChI strings and InChI keys by adding the argument -DRDK_BUILD_INCHI_SUPPORT=ON to your cmake command line.

• You can enable support for the Avalon toolkit by adding the argument -DRDK_BUILD_AVALON_SUPPORT=ON to your cmake command line. • If you’d like to be able to generate high-quality PNGs for structure depiction, you should have cairo installed on your system and build the RDKit with cairo support enabled: -DRDK_BUILD_CAIRO_SUPPORT=ON • If you’d like to be able to use the 3D descriptors, you need to have a copy of eigen3 installed. Most operating systems have an appropriate package.

Building the Java wrappers Additional Requirements • SWIG >v2.0: Building • When you invoke cmake add -D RDK_BUILD_SWIG_WRAPPERS=ON to the arguments. For example: cmake -D RDK_BUILD_SWIG_WRAPPERS=ON. • Build and install normally using make. The directory $RDBASE/Code/JavaWrappers/gmwrapper will contain the three required files: libGraphMolWrap.so (libGraphMolWrap.jnilib on OS X), org.RDKit.jar, and org.RDKitDoc.jar.

Using the wrappers To use the wrappers, the three files need to be in the same directory, and that should be on your CLASSPATH and in the java.library.path. An example using jython. ./ Code / GraphMol / Wrap / EditableMol. Cpp: 114: instantiated from here./ boost / type_traits / detail / cv_traits_impl. Hpp: 37: internal compiler error: in make_rtl_for_nonlocal_decl, at cp / decl.

C: 5067 Please submit a full bug report, with preprocessed source if appropriate. See > for instructions. Preprocessed source stored into / tmp / ccgSaXge. Out file, please attach this to your bugreport. Make [ 2 ]: ** * [ Code / GraphMol / Wrap / CMakeFiles / rdchem. Dir / EditableMol. O ] Error 1 make [ 1 ]: ** * [ Code / GraphMol / Wrap / CMakeFiles / rdchem.

Dir / all ] Error 2 make: * ** [ all ] Error 2 Solution: Add #define BOOST_PYTHON_NO_PY_SIGNATURES at the top of Code/GraphMol/Wrap/EditableMol.cpp More information here: Problem: Your system has a version of boost installed in /usr/lib, but you would like to force the RDKit to use a more recent one. Solution: This can be solved by providing the -D Boost_NO_SYSTEM_PATHS=ON argument. Installation of RDKit binaries • Get the appropriate windows binary build from: • Extract the zip file somewhere without a space in the name, i.e. C: • The rest of this will assume that the installation is in C: RDKit_2015_09_2 • Set the following environment variables: • RDBASE: C: RDKit_2015_09_2 • PYTHONPATH:%RDBASE% if there is already a PYTHONPATH, put;%RDBASE% at the end. • PATH: add;%RDBASE% lib to the end In Win7 systems, you may run into trouble due to missing DLLs, see one thread from the mailing list: You can download the missing DLLs from here: http://www.microsoft.com/en-us/download/details.aspx?id=5555.