/etc/

Age	Commit message (Collapse)	Author
2021-09-20	gnu: Add python-pymol.	Ricardo Wurmus
	* gnu/packages/chemistry.scm (python-pymol): New variable.
2021-06-14	gnu: Rename qtbase to qtbase-5.	Maxim Cournoyer
	This change was automated via the following command: $ git ls-files \| xargs sed -i 's/,qtbase)/,qtbase-5)/g' $ git ls-files \| xargs sed -i 's/inherit qtbase)/inherit qtbase-5)/g' $ git ls-files \| xargs sed -i 's/package-version qtbase)/package-version qtbase-5)/g' $ git checkout etc # to clear some spurious changes This is done so the qtbase package can be upgraded to version 6 in the following commit.
2021-02-01	gnu: openbabel: Update to 3.1.1.	Kei Kebreau
	* gnu/packages/chemistry.scm (openbabel): Update to 3.1.1. [source]: Update URI. [arguments]: Temporarily skip tests on i686-linux.
2021-02-01	gnu: inchi: Update to 1.06.	Kei Kebreau
	* gnu/packages/chemistry.scm (inchi): Update to 1.06. [source]: Use HTTPS. [native-inputs]: Update inchi-doc hash.
2021-01-29	gnu: Remove avogadro.	Leo Famulari
	This package fails to build and has been superseded by avogadro2. * gnu/packages/chemistry.scm (avogadro): Remove variable. * gnu/packages/patches/avogadro-boost148.patch, gnu/packages/patches/avogadro-eigen3-update.patch, gnu/packages/patches/avogadro-python-eigen-lib.patch: Delete files. * gnu/local.mk (dist_patch_DATA): Remove them.
2021-01-25	gnu: Add avogadro2.	Kei Kebreau
	* gnu/packages/chemistry.scm (avogadro2): New variable.
2021-01-25	gnu: Add avogadrolibs.	Kei Kebreau
	* gnu/packages/chemistry.scm (avogadrolibs): New variable.
2021-01-25	gnu: Add libmsym.	Kei Kebreau
	* gnu/packages/chemistry.scm (libmsym): New variable.
2021-01-25	gnu: Add molequeue.	Kei Kebreau
	* gnu/packages/chemistry.scm (molequeue): New variable.
2021-01-25	gnu: Add mmtf-cpp.	Kei Kebreau
	* gnu/packages/chemistry.scm (mmtf-cpp): New variable.
2021-01-25	gnu: Add spglib.	Kei Kebreau
	* gnu/packages/chemistry.scm (spglib): New variable.