Subject: [PATCH 0/5] Update rdkit to 2024.09.6

From: David Elsing <[email-masked]>
Date: Sun, 30 Mar 2025 22:04:10 +0000

This patch series updates rdkit and some of its dependencies.
The build now depends on the CMake files of the NumPy extension of
Boost.Python and rdkit depends on python-numpy anyway, so I added a package
variant of boost with it enabled.

David Elsing (5):
  gnu: inchi: Update to 1.07.3.
  gnu: yaehmop: Update to 2024.03.1.
  gnu: Add boost-with-numpy.
  gnu: Add pubchem-align3d.
  gnu: rdkit: Update to 2024.09.6.

 gnu/packages/boost.scm                        |   8 +
 gnu/packages/chemistry.scm                    | 186 +++++++++++-------
 ...rdkit-unbundle-external-dependencies.patch | 183 +++++++++++++++--
 3 files changed, 291 insertions(+), 86 deletions(-)

-- 
2.48.1