Re: [Rdkit-devel] problem building rdkit

[Greg L. <gre...@gm...>]

hmm, I'm stumped.
I'm going to have to try to reproduce the problem on a linux box.
Since I'm traveling this week (at the ACS in New Orleans), this may take a
while.

-greg


On Mon, Mar 19, 2018 at 8:41 AM, TJ O'Donnell <tj...@ac...> wrote:

> I grep'd with a slight mod to your suggestion and got these few lines.
> There are many others with all lower case boost_thread and boost_serial
>
> tj@vmmint:~/RDKit/rdkit/build$ grep Boost_SERIAL CMakeCache.txt
> Boost_SERIALIZATION_LIBRARY_DEBUG:FILEPATH=/usr/lib/x86_
> 64-linux-gnu/libboost_serialization.so
> Boost_SERIALIZATION_LIBRARY_RELEASE:FILEPATH=/usr/lib/x86_
> 64-linux-gnu/libboost_serialization.so
> //ADVANCED property for variable: Boost_SERIALIZATION_LIBRARY_DEBUG
> Boost_SERIALIZATION_LIBRARY_DEBUG-ADVANCED:INTERNAL=1
> //ADVANCED property for variable: Boost_SERIALIZATION_LIBRARY_RELEASE
> Boost_SERIALIZATION_LIBRARY_RELEASE-ADVANCED:INTERNAL=1
>
> tj@vmmint:~/RDKit/rdkit/build$ grep Boost_THREAD CMakeCache.txt
> Boost_THREAD_LIBRARY_DEBUG:FILEPATH=/usr/lib/x86_64-
> linux-gnu/libboost_thread.so
> Boost_THREAD_LIBRARY_RELEASE:FILEPATH=/usr/lib/x86_64-
> linux-gnu/libboost_thread.so
> //ADVANCED property for variable: Boost_THREAD_LIBRARY_DEBUG
> Boost_THREAD_LIBRARY_DEBUG-ADVANCED:INTERNAL=1
> //ADVANCED property for variable: Boost_THREAD_LIBRARY_RELEASE
> Boost_THREAD_LIBRARY_RELEASE-ADVANCED:INTERNAL=1
>
> The case-insensitive search has lines like this and many more:
>
> tj@vmmint:~/RDKit/rdkit/build$ grep -i boost_SERIAL CMakeCache.txt
> rdqueries_LIB_DEPENDS:STATIC=general;GraphMol;general;
> RDGeometryLib;general;DataStructs;general;RDGeneral;
> general;RDBoost;general;/usr/lib/x86_64-linux-gnu/libpython2.7.so
> ;general;/usr/lib/x86_64-linux-gnu/libboost_python.
> so;general;/usr/lib/x86_64-linux-gnu/libboost_thread.so;
> general;/usr/lib/x86_64-linux-gnu/libboost_system.so;
> general;/usr/lib/x86_64-linux-gnu/libpthread.so;general;/
> usr/lib/x86_64-linux-gnu/libboost_serialization.so;
> rdtrajectory_LIB_DEPENDS:STATIC=general;Trajectory;
> general;RDGeometryLib;general;RDGeneral;general;GraphMol;
> general;/usr/lib/x86_64-linux-gnu/libpython2.7.so;general;/
> usr/lib/x86_64-linux-gnu/libboost_python.so;general;/
> usr/lib/x86_64-linux-gnu/libboost_thread.so;general;/
> usr/lib/x86_64-linux-gnu/libboost_system.so;general;/
> usr/lib/x86_64-linux-gnu/libpthread.so;general;/usr/
> lib/x86_64-linux-gnu/libboost_serialization.so;
>
>
>
>
> On Mon, Mar 19, 2018 at 3:27 AM, Greg Landrum <gre...@gm...>
> wrote:
>
>> Well, I don't see anything obvious there to explain why the serialization
>> library is being treated differently from the others.
>>
>> Could you please look at (and send) the output of;
>> grep boost_THREAD CMakeCache.txt
>> grep boost_SERIAL CMakeCache.txt
>>
>> Best,
>> -greg
>>
>>
>>
>> On Sun, Mar 18, 2018 at 10:31 PM, TJ O'Donnell <tj...@ac...> wrote:
>>
>>> FYI I cloned  https://github.com/rdkit/rdkit.git
>>> and get the same error
>>>
>>> TJ
>>>
>>> On Sun, Mar 18, 2018 at 7:31 PM, TJ O'Donnell <tj...@ac...> wrote:
>>>
>>>> Thanks for the quick reply, Greg.  I just did a git pull and it merged
>>>> in lots of files.
>>>> I may try a clone to a "fresh" folder and see how that goes.
>>>> Anyway, here's the output from  VERBOSE=1 make FilterCatalog
>>>>
>>>> tj@vmmint:~/RDKit/rdkit/build$ VERBOSE=1 make FilterCatalog
>>>> /usr/bin/cmake -H/home/tj/RDKit/rdkit -B/home/tj/RDKit/rdkit/build
>>>> --check-build-system CMakeFiles/Makefile.cmake 0
>>>> make -f CMakeFiles/Makefile2 FilterCatalog
>>>> make[1]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -H/home/tj/RDKit/rdkit -B/home/tj/RDKit/rdkit/build
>>>> --check-build-system CMakeFiles/Makefile.cmake 0
>>>> /usr/bin/cmake -E cmake_progress_start /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 9
>>>> make -f CMakeFiles/Makefile2 Code/GraphMol/FilterCatalog/CM
>>>> akeFiles/FilterCatalog.dir/all
>>>> make[2]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/RDGeneral/CMakeFiles/RDGeneral.dir/build.make
>>>> Code/RDGeneral/CMakeFiles/RDGeneral.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/RDGeneral
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/RDGeneral
>>>> /home/tj/RDKit/rdkit/build/Code/RDGeneral/CMakeFiles/RDGeneral.dir/DependInfo.cmake
>>>> --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/RDGeneral/CMakeFiles/RDGeneral.dir/build.make
>>>> Code/RDGeneral/CMakeFiles/RDGeneral.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/RDGeneral/CMakeFiles/RDG
>>>> eneral.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 64
>>>> [ 11%] Built target RDGeneral
>>>> make -f Code/DataStructs/CMakeFiles/DataStructs.dir/build.make
>>>> Code/DataStructs/CMakeFiles/DataStructs.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/DataStructs
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/DataStructs
>>>> /home/tj/RDKit/rdkit/build/Code/DataStructs/CMakeFiles/DataStructs.dir/DependInfo.cmake
>>>> --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/DataStructs/CMakeFiles/DataStructs.dir/build.make
>>>> Code/DataStructs/CMakeFiles/DataStructs.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/DataStructs/CMakeFiles/D
>>>> ataStructs.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 7
>>>> [ 22%] Built target DataStructs
>>>> make -f Code/Geometry/CMakeFiles/RDGeometryLib.dir/build.make
>>>> Code/Geometry/CMakeFiles/RDGeometryLib.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/Geometry
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/Geometry
>>>> /home/tj/RDKit/rdkit/build/Code/Geometry/CMakeFiles/RDGeometryLib.dir/DependInfo.cmake
>>>> --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/Geometry/CMakeFiles/RDGeometryLib.dir/build.make
>>>> Code/Geometry/CMakeFiles/RDGeometryLib.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/Geometry/CMakeFiles/RDGe
>>>> ometryLib.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 66
>>>> [ 33%] Built target RDGeometryLib
>>>> make -f Code/GraphMol/CMakeFiles/GraphMol.dir/build.make
>>>> Code/GraphMol/CMakeFiles/GraphMol.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/GraphMol
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/GraphMol
>>>> /home/tj/RDKit/rdkit/build/Code/GraphMol/CMakeFiles/GraphMol.dir/DependInfo.cmake
>>>> --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/GraphMol/CMakeFiles/GraphMol.dir/build.make
>>>> Code/GraphMol/CMakeFiles/GraphMol.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/GraphMol/CMakeFiles/Grap
>>>> hMol.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 35 36 37 38
>>>> [ 77%] Built target GraphMol
>>>> make -f Code/GraphMol/Subgraphs/CMakeFiles/Subgraphs.dir/build.make
>>>> Code/GraphMol/Subgraphs/CMakeFiles/Subgraphs.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/GraphMol/Subgraphs
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/GraphMol/Subgraphs
>>>> /home/tj/RDKit/rdkit/build/Code/GraphMol/Subgraphs/CMakeFile
>>>> s/Subgraphs.dir/DependInfo.cmake --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/GraphMol/Subgraphs/CMakeFiles/Subgraphs.dir/build.make
>>>> Code/GraphMol/Subgraphs/CMakeFiles/Subgraphs.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/GraphMol/Subgraphs/CMake
>>>> Files/Subgraphs.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMa
>>>> keFiles
>>>> [ 77%] Built target Subgraphs
>>>> make -f Code/Catalogs/CMakeFiles/Catalogs.dir/build.make
>>>> Code/Catalogs/CMakeFiles/Catalogs.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/Catalogs
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/Catalogs
>>>> /home/tj/RDKit/rdkit/build/Code/Catalogs/CMakeFiles/Catalogs.dir/DependInfo.cmake
>>>> --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/Catalogs/CMakeFiles/Catalogs.dir/build.make
>>>> Code/Catalogs/CMakeFiles/Catalogs.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/Catalogs/CMakeFiles/Cata
>>>> logs.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMa
>>>> keFiles
>>>> [ 77%] Built target Catalogs
>>>> make -f Code/GraphMol/SmilesParse/CMakeFiles/SmilesParse.dir/build.make
>>>> Code/GraphMol/SmilesParse/CMakeFiles/SmilesParse.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/GraphMol/SmilesParse
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/GraphMol/SmilesParse
>>>> /home/tj/RDKit/rdkit/build/Code/GraphMol/SmilesParse/CMakeFi
>>>> les/SmilesParse.dir/DependInfo.cmake --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/GraphMol/SmilesParse/CMakeFiles/SmilesParse.dir/build.make
>>>> Code/GraphMol/SmilesParse/CMakeFiles/SmilesParse.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/GraphMol/SmilesParse/CMa
>>>> keFiles/SmilesParse.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMakeFiles
>>>> 71
>>>> [ 88%] Built target SmilesParse
>>>> make -f Code/GraphMol/Substruct/CMakeFiles/SubstructMatch.dir/build.make
>>>> Code/GraphMol/Substruct/CMakeFiles/SubstructMatch.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/GraphMol/Substruct
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/GraphMol/Substruct
>>>> /home/tj/RDKit/rdkit/build/Code/GraphMol/Substruct/CMakeFile
>>>> s/SubstructMatch.dir/DependInfo.cmake --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/GraphMol/Substruct/CMakeFiles/SubstructMatch.dir/build.make
>>>> Code/GraphMol/Substruct/CMakeFiles/SubstructMatch.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> make[3]: Nothing to be done for `Code/GraphMol/Substruct/CMake
>>>> Files/SubstructMatch.dir/build'.
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> /usr/bin/cmake -E cmake_progress_report /home/tj/RDKit/rdkit/build/CMa
>>>> keFiles
>>>> [ 88%] Built target SubstructMatch
>>>> make -f Code/GraphMol/FilterCatalog/CMakeFiles/FilterCatalog.dir/build.make
>>>> Code/GraphMol/FilterCatalog/CMakeFiles/FilterCatalog.dir/depend
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> cd /home/tj/RDKit/rdkit/build && /usr/bin/cmake -E cmake_depends "Unix
>>>> Makefiles" /home/tj/RDKit/rdkit /home/tj/RDKit/rdkit/Code/GraphMol/FilterCatalog
>>>> /home/tj/RDKit/rdkit/build /home/tj/RDKit/rdkit/build/Code/GraphMol/FilterCatalog
>>>> /home/tj/RDKit/rdkit/build/Code/GraphMol/FilterCatalog/CMake
>>>> Files/FilterCatalog.dir/DependInfo.cmake --color=
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make -f Code/GraphMol/FilterCatalog/CMakeFiles/FilterCatalog.dir/build.make
>>>> Code/GraphMol/FilterCatalog/CMakeFiles/FilterCatalog.dir/build
>>>> make[3]: Entering directory `/home/tj/RDKit/rdkit/build'
>>>> Linking CXX shared library ../../../lib/libRDKitFilterCatalog.so
>>>> cd /home/tj/RDKit/rdkit/build/Code/GraphMol/FilterCatalog &&
>>>> /usr/bin/cmake -E cmake_link_script CMakeFiles/FilterCatalog.dir/link.txt
>>>> --verbose=1
>>>> /usr/bin/c++  -fPIC  -mpopcnt -Wno-deprecated -Wno-unused-function
>>>> -fno-strict-aliasing -Wall -Wextra -fPIC -O3 -DNDEBUG   -shared
>>>> -Wl,-soname,libRDKitFilterCatalog.so.1 -o
>>>> ../../../lib/libRDKitFilterCatalog.so.1.2018.03.1.dev1
>>>> CMakeFiles/FilterCatalog.dir/Filters.cpp.o
>>>> CMakeFiles/FilterCatalog.dir/FilterCatalog.cpp.o
>>>> CMakeFiles/FilterCatalog.dir/FilterCatalogEntry.cpp.o
>>>> CMakeFiles/FilterCatalog.dir/FilterMatchers.cpp.o
>>>> CMakeFiles/FilterCatalog.dir/FunctionalGroupHierarchy.cpp.o
>>>> ../../../lib/libRDKitSubgraphs.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitSubstructMatch.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitSmilesParse.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitGraphMol.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitRDGeometryLib.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitCatalogs.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitRDGeneral.so.1.2018.03.1.dev1
>>>> -lBoost::serialization ../../../lib/libRDKitDataStructs.so.1.2018.03.1.dev1
>>>> ../../../lib/libRDKitRDGeneral.so.1.2018.03.1.dev1 -lboost_thread
>>>> -lboost_system -lpthread -Wl,-rpath,/home/tj/RDKit/rdkit/build/lib:
>>>> /usr/bin/ld: cannot find -lBoost::serialization
>>>> collect2: error: ld returned 1 exit status
>>>> make[3]: *** [lib/libRDKitFilterCatalog.so.1.2018.03.1.dev1] Error 1
>>>> make[3]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make[2]: *** [Code/GraphMol/FilterCatalog/C
>>>> MakeFiles/FilterCatalog.dir/all] Error 2
>>>> make[2]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make[1]: *** [Code/GraphMol/FilterCatalog/C
>>>> MakeFiles/FilterCatalog.dir/rule] Error 2
>>>> make[1]: Leaving directory `/home/tj/RDKit/rdkit/build'
>>>> make: *** [FilterCatalog] Error 2
>>>>
>>>> On Sun, Mar 18, 2018 at 3:48 PM, Greg Landrum <gre...@gm...>
>>>> wrote:
>>>>
>>>>> Hi TJ,
>>>>>
>>>>> Hrm, that's ugly. Just to confirm: Are you building the master branch
>>>>> from github?
>>>>> It looks like there's no fundamental problem with master; at least the
>>>>> travis builds pass: https://travis-ci.org/rdkit/rdkit
>>>>>
>>>>> To help track this down, can you please send the results of doing:
>>>>> VERBOSE=1 make FilterCatalog
>>>>>
>>>>> Best,
>>>>> -greg
>>>>>
>>>>>
>>>>> On Sun, Mar 18, 2018 at 11:27 PM, TJ O'Donnell <tj...@ac...> wrote:
>>>>>
>>>>>> I'm trying to build rdkit from the latest git source.
>>>>>> Linux Mint 17
>>>>>>
>>>>>> I get this error
>>>>>> [ 57%] Building CXX object Code/GraphMol/FilterCatalog/CM
>>>>>> akeFiles/FilterCatalog.dir/FunctionalGroupHierarchy.cpp.o
>>>>>> Linking CXX shared library ../../../lib/libRDKitFilterCatalog.so
>>>>>> /usr/bin/ld: cannot find -lBoost::serialization
>>>>>> collect2: error: ld returned 1 exit status
>>>>>> make[2]: *** [lib/libRDKitFilterCatalog.so.1.2018.03.1.dev1] Error 1
>>>>>> make[1]: *** [Code/GraphMol/FilterCatalog/C
>>>>>> MakeFiles/FilterCatalog.dir/all] Error 2
>>>>>> make: *** [all] Error 2
>>>>>>
>>>>>> but cmake seemed to find this lib OK
>>>>>> cmake .. -DRDK_BUILD_INCHI_SUPPORT=ON
>>>>>> -- The C compiler identification is GNU 4.8.4
>>>>>> -- The CXX compiler identification is GNU 4.8.4
>>>>>> ....
>>>>>> -- Found Threads: TRUE
>>>>>> -- Boost version: 1.54.0
>>>>>> -- Found the following Boost libraries:
>>>>>> --   thread
>>>>>> --   system
>>>>>> -- Boost version: 1.54.0
>>>>>> -- Found the following Boost libraries:
>>>>>> --   serialization
>>>>>> == Using strict rotor definition
>>>>>> == Updating Filters.cpp from pains file
>>>>>>
>>>>>> Can you help me figure out how to get past this?
>>>>>>
>>>>>> Thanks,
>>>>>> TJ
>>>>>>
>>>>>> ------------------------------------------------------------
>>>>>> ------------------
>>>>>> Check out the vibrant tech community on one of the world's most
>>>>>> engaging tech sites, Slashdot.org! http://sdm.link/slashdot
>>>>>> _______________________________________________
>>>>>> Rdkit-devel mailing list
>>>>>> Rdk...@li...
>>>>>> https://lists.sourceforge.net/lists/listinfo/rdkit-devel
>>>>>>
>>>>>>
>>>>>
>>>>
>>>
>>
>