index
:
guix.git
core-updates
core-updates-glibc-2.39
emacs-team
gnome-team
go-team
guile-daemon
haskell-team
hurd-team
install-doc-overhaul
kde-team
kernel-updates
keyring
master
old-core-updates
old-guix-wip-file-offset-bits-64-sledgehammer
python-team
r-updates
rust-team
tex-team
version-0.10.0
version-0.11.0
version-0.12.0
version-0.13.0
version-0.14.0
version-0.15.0
version-0.16.0
version-0.8.3
version-0.9.0
version-1.0.0
version-1.0.1
version-1.1.0
version-1.2.0
version-1.3.0
version-1.4.0
wip-aarch64-bootstrap
wip-arm-bootstrap
wip-buildroot
wip-check
wip-container
wip-cpu-tuning
wip-deploy
wip-deploy2
wip-desktop
wip-digests
wip-file-offset-bits-64
wip-file-offset-bits-64-sledgehammer
wip-filesearch
wip-full-source-bootstrap
wip-gexp-grafts
wip-gexp-hygiene
wip-git-https
wip-gmp
wip-guix-log
wip-harden-installer
wip-hurd-vm
wip-ipfs
wip-ipfs-substitutes
wip-ipfs2
wip-java-aarch64
wip-kde-education
wip-kde-plasma
wip-loongson2f
wip-mediagoblin
wip-mnt-reform
wip-node-14
wip-node-18-updates
wip-node-importer
wip-node-reproducibility
wip-ocaml
wip-pandas-upgrade
wip-perl6
wip-pinebook-pro
wip-plmshift
wip-postfix
wip-ppc
wip-ppc64le
wip-python-mne
wip-python-team
wip-r
wip-r-team
wip-rust
wip-system-bootstrap
wip-webkit
Mirror of the official guix repository
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gnu
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chemistry.scm
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Commit message (
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Author
2022-05-31
gnu: Remove python2-numpy.
Maxim Cournoyer
2022-05-31
gnu: Remove nmoldyn.
Maxim Cournoyer
2022-05-31
gnu: Remove domainfinder.
Maxim Cournoyer
2021-12-13
gnu: Simplify package inputs.
Ludovic Courtès
2021-10-12
Merge remote-tracking branch 'origin/master' into core-updates-frozen.
Mathieu Othacehe
2021-09-20
gnu: Add python-pymol.
Ricardo Wurmus
2021-07-24
gnu: Use 'search-input-file' when looking for executables.
Ludovic Courtès
2021-06-14
gnu: Rename qtbase to qtbase-5.
Maxim Cournoyer
2021-02-01
gnu: openbabel: Update to 3.1.1.
Kei Kebreau
2021-02-01
gnu: inchi: Update to 1.06.
Kei Kebreau
2021-01-29
gnu: Remove avogadro.
Leo Famulari
2021-01-25
gnu: Add avogadro2.
Kei Kebreau
2021-01-25
gnu: Add avogadrolibs.
Kei Kebreau
2021-01-25
gnu: Add libmsym.
Kei Kebreau
2021-01-25
gnu: Add molequeue.
Kei Kebreau
2021-01-25
gnu: Add mmtf-cpp.
Kei Kebreau
2021-01-25
gnu: Add spglib.
Kei Kebreau
2020-07-12
gnu: Remove ".git" from "https://github/…/….git".
Ludovic Courtès
2020-05-04
gnu: Add gromacs.
Vincent Legoll
2020-05-04
gnu: Add tng.
Vincent Legoll
2020-04-26
gnu: nmoldyn: Adjust for Guile 3.0.
Marius Bakke
2020-03-05
gnu: domainfinder: Update home page URI.
Björn Höfling
2020-03-05
gnu: nmoldyn: Upate home page URI.
Björn Höfling
2019-11-21
gnu: nmoldyn: New source code location.
Konrad Hinsen
2019-02-08
gnu: avogadro: Don't use unstable tarball.
Tobias Geerinckx-Rice
2019-01-15
gnu: Separate Python core packages from the rest.
Ricardo Wurmus
2018-12-17
gnu: avogadro: Don't hardcode python version.
Efraim Flashner
2018-08-25
gnu: Add avogadro.
Kei Kebreau
2018-07-22
gnu: chemistry.scm: Add missing import.
Marius Bakke
2018-07-21
gnu: openbabel: Fix crash when opening NWChem output files.
Kei Kebreau
2018-07-17
gnu: Add openbabel.
Kei Kebreau
2018-07-13
gnu: Add inchi.
Kei Kebreau
2018-03-17
gnu: Fix common unquote typos.
Tobias Geerinckx-Rice
2018-01-05
gnu: Add nmoldyn.
Konrad Hinsen
2018-01-05
gnu: Add domainfinder.
Konrad Hinsen
