Re: [Rdkit-discuss] RDKIT Build Problems

2019-03-06 Thread Markus Sitzmann
Thanks Greg. 

I have the problem at CI, too. It was 100% failure rate the last two days. At 
home, occasionally. At least, it isn’t only me :-)

Markus


-
|  Markus Sitzmann
|  markus.sitzm...@gmail.com

> On 6. Mar 2019, at 17:25, Greg Landrum  wrote:
> 
> 
> 
>> On Wed, Mar 6, 2019 at 1:15 PM Markus Sitzmann  
>> wrote:
>> 
>> Does someone maybe has the same problem? And an explanation whats going on - 
>> the Avalon tools seemed to be unchanged since quite a while.
> 
> I've seen it a couple of times in the CI builds for the RDKit over the past 
> couple of days. It's caused by downloads failing since sourceforge is 
> unreliable.
> 
> -greg
> 
> 
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Re: [Rdkit-discuss] RDKIT Build Problems

2019-03-06 Thread Greg Landrum
On Wed, Mar 6, 2019 at 1:15 PM Markus Sitzmann 
wrote:

>
> Does someone maybe has the same problem? And an explanation whats going on
> - the Avalon tools seemed to be unchanged since quite a while.
>

I've seen it a couple of times in the CI builds for the RDKit over the past
couple of days. It's caused by downloads failing since sourceforge is
unreliable.

-greg
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[Rdkit-discuss] RDKIT Build Problems

2019-03-06 Thread Markus Sitzmann
Hi everybody,

Currently (the last couple of days) the build of one of my Docker images
stopped working:

https://github.com/chembience/chembience/blob/develop/context/build/rdkit-postgres-compile/Dockerfile

That occurred to me sporadically already over the last few years and
usually disappeared after a rebuild. Currently it is annoying enough to
write an email. The build ends with:

"""
== Using strict rotor definition
Downloading
http://sourceforge.net/projects/avalontoolkit/files/AvalonToolkit_1.2/AvalonToolkit_1.2.0.source.tar.
..
  % Total% Received % Xferd  Average Speed   TimeTime Time
Current
 Dload  Upload   Total   SpentLeft
Speed

100   178  100   1780 0   1181  0 --:--:-- --:--:-- --:--:--
1186
  0 00 00 0  0  0 --:--:-- --:--:-- --:--:--
 0
curl: (35) Unknown SSL protocol error in connection to sourceforge.net:443
*CMake Error at Code/cmake/Modules/RDKitUtils.cmake:215 (MESSAGE):*
*  The md5 checksum for*
*  /opt/rdkit/External/AvalonTools/AvalonToolkit_1.2.0.source.tar is*
*  incorrect; expected: 092a94f421873f038aa67d4a6cc8cb54, found:*
*  d41d8cd98f00b204e9800998ecf8427e*
*Call Stack (most recent call first):*
*  External/AvalonTools/CMakeLists.txt:29 (downloadAndCheckMD5)*


-- Configuring incomplete, errors occurred!
See also "/opt/rdkit/build/CMakeFiles/CMakeOutput.log".
See also "/opt/rdkit/build/CMakeFiles/CMakeError.log".
ERROR: Service 'rdkit-postgres-compile' failed to build: The command
'/bin/sh -c wget --quiet -O -
https://www.postgresql.org/media/keys/ACCC4CF8.asc | apt-key add -  && echo
'deb http://apt.postgresql.org/pub/repos/apt/ stretch-pgdg main' >
/etc/apt/sources.list.d/pgdg.list  && apt-get update && apt-get install -y
--no-install-recommends  postgresql-server-dev-all
 postgresql-client postgresql-plpython-${PG_VERSION}
 postgresql-plpython3-${PG_VERSION} python-numpy python-dev
 sqlite3 libsqlite3-dev libboost-dev libboost-system-dev
 libboost-thread-dev libboost-serialization-dev
 libboost-python-dev libboost-regex-dev libeigen3-dev && git
clone -b $RDKIT_BRANCH --single-branch https://github.com/rdkit/rdkit.git
&& mkdir $RDBASE/build && cd $RDBASE/build && cmake
 -DRDK_BUILD_INCHI_SUPPORT=ON   -DRDK_BUILD_PGSQL=ON
 -DRDK_BUILD_AVALON_SUPPORT=ON
 -DPostgreSQL_TYPE_INCLUDE_DIR="/usr/include/postgresql/${PG_VERSION}/server"
 -DPostgreSQL_ROOT="/usr/lib/postgresql/${PG_VERSION}" .. && make
-j `nproc` && make install' returned a non-zero code: 1
Exited with code 1
"""

Does someone maybe has the same problem? And an explanation whats going on
- the Avalon tools seemed to be unchanged since quite a while.

Thanks,
Markus
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