Your message dated Thu, 08 Feb 2024 15:32:58 +0100
with message-id <[email protected]>
and subject line close
has caused the Debian Bug report #1060971,
regarding mdtraj: FTBFS: dpkg-buildpackage: error: dpkg-source -b . subprocess 
returned exit status 2
to be marked as done.

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If this is not the case it is now your responsibility to reopen the
Bug report if necessary, and/or fix the problem forthwith.

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-- 
1060971: https://bugs.debian.org/cgi-bin/bugreport.cgi?bug=1060971
Debian Bug Tracking System
Contact [email protected] with problems
--- Begin Message ---
Source: mdtraj
Version: 1.9.7-6
Severity: serious
Justification: FTBFS
Tags: trixie sid ftbfs
User: [email protected]
Usertags: ftbfs-20240115 ftbfs-trixie

Hi,

During a rebuild of all packages in sid, your package failed to build
on amd64.


Relevant part (hopefully):
> make[1]: Entering directory '/<<PKGBUILDDIR>>'
> dh_auto_clean || /bin/true
> I: pybuild base:305: python3.12 setup.py clean 
> Using built-in specs.
> COLLECT_GCC=/usr/bin/x86_64-linux-gnu-gcc
> COLLECT_LTO_WRAPPER=/usr/libexec/gcc/x86_64-linux-gnu/13/lto-wrapper
> OFFLOAD_TARGET_NAMES=nvptx-none:amdgcn-amdhsa
> OFFLOAD_TARGET_DEFAULT=1
> Target: x86_64-linux-gnu
> Configured with: ../src/configure -v --with-pkgversion='Debian 13.2.0-9' 
> --with-bugurl=file:///usr/share/doc/gcc-13/README.Bugs 
> --enable-languages=c,ada,c++,go,d,fortran,objc,obj-c++,m2 --prefix=/usr 
> --with-gcc-major-version-only --program-suffix=-13 
> --program-prefix=x86_64-linux-gnu- --enable-shared --enable-linker-build-id 
> --libexecdir=/usr/libexec --without-included-gettext --enable-threads=posix 
> --libdir=/usr/lib --enable-nls --enable-bootstrap --enable-clocale=gnu 
> --enable-libstdcxx-debug --enable-libstdcxx-time=yes 
> --with-default-libstdcxx-abi=new --enable-gnu-unique-object 
> --disable-vtable-verify --enable-plugin --enable-default-pie 
> --with-system-zlib --enable-libphobos-checking=release 
> --with-target-system-zlib=auto --enable-objc-gc=auto --enable-multiarch 
> --disable-werror --enable-cet --with-arch-32=i686 --with-abi=m64 
> --with-multilib-list=m32,m64,mx32 --enable-multilib --with-tune=generic 
> --enable-offload-targets=nvptx-none=/build/reproducible-path/gcc-13-13.2.0/debian/tmp-nvptx/usr,amdgcn-amdhsa=/build/reproducible-path/gcc-13-13.2.0/debian/tmp-gcn/usr
>  --enable-offload-defaulted --without-cuda-driver --enable-checking=release 
> --build=x86_64-linux-gnu --host=x86_64-linux-gnu --target=x86_64-linux-gnu 
> --with-build-config=bootstrap-lto-lean --enable-link-serialization=2
> Thread model: posix
> Supported LTO compression algorithms: zlib zstd
> gcc version 13.2.0 (Debian 13.2.0-9) 
> /<<PKGBUILDDIR>>/basesetup.py:431: UserWarning: Unrecognized setuptools 
> command ('clean'), proceeding with generating Cython sources and expanding 
> templates
>   warnings.warn("Unrecognized setuptools command ('{}'), proceeding with "
> warning: mdtraj/formats/dcd/dcdlib.pxd:12:12: Non-trivial type declarators in 
> shared declaration (e.g. mix of pointers and values). Each pointer 
> declaration should be on its own line.
> warning: mdtraj/formats/dcd/dcdlib.pxd:12:16: Non-trivial type declarators in 
> shared declaration (e.g. mix of pointers and values). Each pointer 
> declaration should be on its own line.
> warning: mdtraj/formats/dcd/dcdlib.pxd:12:20: Non-trivial type declarators in 
> shared declaration (e.g. mix of pointers and values). Each pointer 
> declaration should be on its own line.
> performance hint: mdtraj/geometry/src/image_molecules.pxi:13:5: Exception 
> check on 'make_whole' will always require the GIL to be acquired.
> Possible solutions:
>       1. Declare 'make_whole' as 'noexcept' if you control the definition and 
> you're sure you don't want the function to raise exceptions.
>       2. Use an 'int' return type on 'make_whole' to allow an error code to 
> be returned.
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>             offset[k] += frame_unitcell_vectors[0, 
> k]*roundf((delta[0]-offset[0])/frame_unitcell_vectors[0,0])
>             frame_positions[atom2, k] = frame_positions[atom2, k] - offset[k]
> 
> cdef void anchor_dists(float[:,::1] frame_positions,
>                   float[:,::1] frame_unitcell_vectors,
>                   vector[int[:]] anchor_molecules,
>                         ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:33:24: Reference-counted type 
> 'int[:]' cannot be used as a template argument
> performance hint: mdtraj/geometry/src/image_molecules.pxi:31:5: Exception 
> check on 'anchor_dists' will always require the GIL to be acquired.
> Possible solutions:
>       1. Declare 'anchor_dists' as 'noexcept' if you control the definition 
> and you're sure you don't want the function to raise exceptions.
>       2. Use an 'int' return type on 'anchor_dists' to allow an error code to 
> be returned.
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>             anchor_nearest_atoms[mol2, mol1, 1] = ca2
> 
> cdef void wrap_mols(float[:,::1] frame_positions,
>                     float[:,::1] frame_unitcell_vectors,
>                     float[:] center,
>                     vector[int[:]] other_molecules) nogil:
>                           ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:55:26: Reference-counted type 
> 'int[:]' cannot be used as a template argument
> performance hint: mdtraj/geometry/src/image_molecules.pxi:52:5: Exception 
> check on 'wrap_mols' will always require the GIL to be acquired.
> Possible solutions:
>       1. Declare 'wrap_mols' as 'noexcept' if you control the definition and 
> you're sure you don't want the function to raise exceptions.
>       2. Use an 'int' return type on 'wrap_mols' to allow an error code to be 
> returned.
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
> 
> 
> cdef void image_frame(frame_positions,
>                  frame_unitcell_vectors,
>                  anchor_molecules,
>                  vector[int[:]] other_molecules,
>                        ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:96:23: Reference-counted type 
> 'int[:]' cannot be used as a template argument
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>     anchor_atom_indices = np.concatenate(anchor_molecules)
>     center = np.mean(frame_positions[anchor_atom_indices], axis=0)
>     wrap_mols(frame_positions, frame_unitcell_vectors, center, 
> other_molecules)
> 
> def image_molecules(xyz, box, anchor_molecules, other_molecules, 
> sorted_bonds):
>     cdef vector[int[:]] omol = other_molecules
>                ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:144:15: Reference-counted type 
> 'int[:]' cannot be used as a template argument
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>     cdef int[:] mol
>     cdef float mol_center[3]
>     cdef float mol_offset[3]
> 
>     cdef int n
>     for i in range(other_molecules.size()):
>                                        ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:72:39: Coercion from Python not 
> allowed without the GIL
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>     cdef int[:] mol
>     cdef float mol_center[3]
>     cdef float mol_offset[3]
> 
>     cdef int n
>     for i in range(other_molecules.size()):
>                                        ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:72:39: Calling gil-requiring function 
> not allowed without gil
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>     cdef int[:] mol
>     cdef float mol_center[3]
>     cdef float mol_offset[3]
> 
>     cdef int n
>     for i in range(other_molecules.size()):
>                                   ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:72:34: Accessing Python attribute not 
> allowed without gil
> 
> Error compiling Cython file:
> ------------------------------------------------------------
> ...
>     cdef int[:] mol
>     cdef float mol_center[3]
>     cdef float mol_offset[3]
> 
>     cdef int n
>     for i in range(other_molecules.size()):
>                                        ^
> ------------------------------------------------------------
> 
> mdtraj/geometry/src/image_molecules.pxi:72:39: Constructing Python tuple not 
> allowed without gil
> C compiler:
> Attempting to autodetect OpenMP support... Compiler supports OpenMP
> Attempting to autodetect SSE3   support... Compiler supports SSE3
> Attempting to autodetect SSE4.1 support... Compiler supports SSE4.1
> Attempting to autodetect NEON   support... Did not detect NEON support
> 
> [ 1/12] Cythonizing mdtraj/formats/binpos/binpos.pyx
> [ 2/12] Cythonizing mdtraj/formats/dcd/dcd.pyx
> [ 3/12] Cythonizing mdtraj/formats/dtr/dtr.pyx
> [ 4/12] Cythonizing mdtraj/formats/tng/tng.pyx
> [ 5/12] Cythonizing mdtraj/formats/xtc/trr.pyx
> [ 6/12] Cythonizing mdtraj/formats/xtc/xtc.pyx
> [ 7/12] Cythonizing mdtraj/geometry/drid.pyx
> [ 8/12] Cythonizing mdtraj/geometry/neighborlist.pyx
> [ 9/12] Cythonizing mdtraj/geometry/neighbors.pyx
> [10/12] Cythonizing mdtraj/geometry/src/_geometry.pyx
> Traceback (most recent call last):
>   File "/<<PKGBUILDDIR>>/setup.py", line 301, in <module>
>     metadata['ext_modules'] = cythonize(
>                               ^^^^^^^^^^
>   File "/usr/lib/python3/dist-packages/Cython/Build/Dependencies.py", line 
> 1154, in cythonize
>     cythonize_one(*args)
>   File "/usr/lib/python3/dist-packages/Cython/Build/Dependencies.py", line 
> 1321, in cythonize_one
>     raise CompileError(None, pyx_file)
> Cython.Compiler.Errors.CompileError: mdtraj/geometry/src/_geometry.pyx
> E: pybuild pybuild:391: clean: plugin distutils failed with: exit code=1: 
> python3.12 setup.py clean 
> dh_auto_clean: error: pybuild --clean -i python{version} -p "3.12 3.11" 
> returned exit code 13
> for f in mdtraj/formats/binpos/binpos.c \
>   mdtraj/formats/dcd/dcd.c            \
>   mdtraj/formats/dtr/dtr.cpp          \
>   mdtraj/formats/tng/tng.c            \
>   mdtraj/formats/xtc/trr.c            \
>   mdtraj/formats/xtc/xtc.c            \
>   mdtraj/geometry/drid.cpp            \
>   mdtraj/geometry/neighborlist.cpp    \
>   mdtraj/geometry/neighbors.cpp               \
>   mdtraj/geometry/src/_geometry.cpp   \
>   mdtraj/rmsd/_lprmsd.cpp             \
>   mdtraj/rmsd/_rmsd.cpp                       \
>   mdtraj/version.py;                    \
> do rm -f $f; done
> rm -rf __pycache__
> make[1]: Leaving directory '/<<PKGBUILDDIR>>'
>    dh_autoreconf_clean -O--buildsystem=pybuild
>    dh_clean -O--buildsystem=pybuild
>  dpkg-source -b .
> dpkg-source: info: using options from mdtraj-1.9.7/debian/source/options: 
> --extend-diff-ignore=^[^/]*[.]egg-info/
> dpkg-source: info: using source format '3.0 (quilt)'
> dpkg-source: info: building mdtraj using existing ./mdtraj_1.9.7.orig.tar.gz
> dpkg-source: info: using patch list from debian/patches/series
> dpkg-source: info: local changes detected, the modified files are:
>  mdtraj-1.9.7/.pybuild/cpython3_3.12_mdtraj/.pydistutils.cfg
> dpkg-source: error: aborting due to unexpected upstream changes, see 
> /tmp/mdtraj_1.9.7-6.diff.4gSP2o
> dpkg-source: info: Hint: make sure the version in debian/changelog matches 
> the unpacked source tree
> dpkg-source: info: you can integrate the local changes with dpkg-source 
> --commit
> dpkg-buildpackage: error: dpkg-source -b . subprocess returned exit status 2
> --------------------------------------------------------------------------------
> Build finished at 2024-01-15T20:15:36Z


The full build log is available from:
http://qa-logs.debian.net/2024/01/15/mdtraj_1.9.7-6_unstable.log

All bugs filed during this archive rebuild are listed at:
https://bugs.debian.org/cgi-bin/pkgreport.cgi?tag=ftbfs-20240115;[email protected]
or:
https://udd.debian.org/bugs/?release=na&merged=ign&fnewerval=7&flastmodval=7&fusertag=only&fusertagtag=ftbfs-20240115&[email protected]&allbugs=1&cseverity=1&ctags=1&caffected=1#results

A list of current common problems and possible solutions is available at
http://wiki.debian.org/qa.debian.org/FTBFS . You're welcome to contribute!

If you reassign this bug to another package, please mark it as 'affects'-ing
this package. See https://www.debian.org/Bugs/server-control#affects

If you fail to reproduce this, please provide a build log and diff it with mine
so that we can identify if something relevant changed in the meantime.

--- End Message ---
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