Gentoo Packages

sci-chemistry/openbabel (gentoo)

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Install

Install this package:

emerge -a sci-chemistry/openbabel

If the package is masked, you can unmask it using the autounmask tool or standard emerge options:

autounmask sci-chemistry/openbabel

Or alternatively:

emerge --autounmask-write -a sci-chemistry/openbabel

Package Information

Description:
Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone to search, convert, analyze, or store data from molecular modeling, chemistry, solid-state materials, biochemistry, or related areas.
Homepage:
https://openbabel.org/ https://github.com/openbabel/openbabel/
License:
GPL-2

Versions

Version EAPI Keywords Slot
9999 8 ~amd64 ~arm ~x86 0/7.0.0
3.1.1_p20241221-r4 8 amd64 ~arm ~x86 0/7.0.0
3.1.1_p20241221-r2 8 amd64 ~arm ~x86 0/7.0.0

Metadata

Description

Maintainers

Upstream

Raw Metadata XML 
<pkgmetadata>
	<maintainer type="project">
		<email>sci-chemistry@gentoo.org</email>
		<name>Gentoo Chemistry Project</name>
	</maintainer>
	<longdescription>
		Open Babel is a chemical toolbox designed to speak the many languages of
		chemical data. It's an open, collaborative project allowing anyone to
		search, convert, analyze, or store data from molecular modeling, chemistry,
		solid-state materials, biochemistry, or related areas.
	</longdescription>
	<use>
		<flag name="inchi">Build support for IUPAC International Chemical Identifier format</flag>
		<flag name="json">Build support for JSON formats (ChemDoodle, PubChem, etc...)</flag>
	</use>
	<upstream>
		<remote-id type="sourceforge">openbabel</remote-id>
		<remote-id type="github">openbabel/openbabel</remote-id>
	</upstream>
</pkgmetadata>

Lint Warnings

USE Flags

Manage flags for this package: euse -i <flag> -p sci-chemistry/openbabel | euse -E <flag> -p sci-chemistry/openbabel | euse -D <flag> -p sci-chemistry/openbabel

Flag Description 9999 3.1.1_p20241221-r4 3.1.1_p20241221-r2
cpu_flags_arm_neon Use the NEON instruction set ✓ ✓ ✓
cpu_flags_x86_sse2 Use the SSE2 instruction set ✓ ✓ ✓
cpu_flags_x86_sse4_2 Enable SSE4.2 instruction support ✓ ✓ ✓
doc Add extra documentation (API, Javadoc, etc). It is recommended to enable per package instead of globally ✓ ✓ ✓
examples Install examples, usually source code ✓ ✓ ✓
inchi Build support for IUPAC International Chemical Identifier format ⊕ ⊕ ⊕
json Build support for JSON formats (ChemDoodle, PubChem, etc...) ✓ ✓ ✓
minimal Install a very minimal build (disables, for example, plugins, fonts, most drivers, non-critical features) ✓ ✓ ✓
openmp Build support for the OpenMP (support parallel computing), requires >=sys-devel/gcc-4.2 built with USE="openmp" ✓ ✓ ✓
perl Add optional support/bindings for the Perl language ✓ ✓ ✓
png Add support for libpng (PNG images) ✓ ✓ ✓
python Add optional support/bindings for the Python language ✓ ✓ ✓
test Enable dependencies and/or preparations necessary to run tests (usually controlled by FEATURES=test but can be toggled independently) ✓ ✓ ✓
wxwidgets Add support for wxWidgets/wxGTK GUI toolkit ✓ ✓ ✓

Files

Manifest

Type File Size Versions
Unmatched Entries
Type File Size
DIST openbabel-3.1.1_p20241221.tar.gz 36864825 bytes