Debian 12 (Bookworm) native package

gromacs

Molecular dynamics simulator, with building and analysis tools

Packages / Debian 12 (Bookworm) / science / gromacs

Package: gromacs (2022.5-2)

Maintainers:

Debichem Team

External Resources:

Homepage: [www.gromacs.org]

Molecular dynamics simulator, with building and analysis tools

Other Packages Related to gromacs:

dep: [gromacs-data] (= 2022.5-2)
GROMACS molecular dynamics sim, data and documentation
dep: [sse4.2-support]
CPU feature checking - require SSE4.2
dep: [libc6] (>= 2.34)
GNU C Library: Shared libraries
dep: [libgcc-s1] (>= 3.0)
GCC support library
dep: [libgromacs7] (>= 2022.5)
GROMACS molecular dynamics sim, shared libraries
dep: [libopenmpi3] (>= 4.1.4)
high performance message passing library -- shared library
dep: [libstdc++6] (>= 11)
GNU Standard C++ Library v3
dep: [libx11-6]
X11 client-side library

rec: [cpp]
GNU C preprocessor (cpp)
rec: [mpi-default-bin]
Standard MPI runtime programs (metapackage)

sug: [pymol]
Molecular Graphics System

Download gromacs

Architecture	Package Size	Installed Size	Files
amd64	137 KiB	727 KiB	[list of files]
arm64	131 KiB	857 KiB	[list of files]

Package file paths (11)

Paths come from the repository package-file index for the observed builds. They describe archive/package associations, not every file that will exist on a running system after maintainer scripts, alternatives, generated state, diversions, or installation choices.

/usr/bin/demux
/usr/bin/gmx
/usr/bin/gmx_d
/usr/bin/gmx_mpi
/usr/bin/gmx_mpi_d
/usr/bin/xplor2gmx
/usr/share/doc/gromacs/AUTHORS
/usr/share/doc/gromacs/changelog.Debian.gz
/usr/share/doc/gromacs/copyright
/usr/share/doc/gromacs/README.Debian
/usr/share/doc/gromacs/README.gz

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

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OpenFactory can boot this operating system in a browser VM, or start a build that includes the native package name from this record.

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Versions, suites, and repositories

Each row is recorded package-index metadata for one version, architecture, suite, and repository. Names, URLs, and sizes are source-reported; a link is a potentially mutable retrieval location, not an OpenFactory redistribution claim or proof that OpenFactory retained the artifact bytes.

Version	Release	Architecture	Repository	Package size	Installed size	Publisher repository artifact
2022.5-2	bookworm / main	amd64	Debian 12 · main · amd64	137 KiB	727 KiB	pool/main/g/gromacs/gromacs_2022.5-2_amd64.deb
2022.5-2	bookworm / main	arm64	Debian 12 · main · arm64	131 KiB	857 KiB	pool/main/g/gromacs/gromacs_2022.5-2_arm64.deb

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

Checksums and observation dates

For an APT source, signature verification authenticates the repository metadata chain and the Packages index containing this source-reported artifact digest. It does not certify package safety.

2022.5-2 / amd64Observed Sep 1, 2026 to Sep 1, 2026

Verification status: Metadata observed; artifact bytes were not independently fetched or hashed by this catalog import. The digest below is source-reported.

Source-reported sha256: abbd33c546080a5405e153e9d5064ff557b6566fffea83885ade6d44f29fc1a0

After downloading that exact artifact, compare its bytes with the source-reported expected digest:

printf '%s  %s\n' 'abbd33c546080a5405e153e9d5064ff557b6566fffea83885ade6d44f29fc1a0' 'gromacs_2022.5-2_amd64.deb' | sha256sum --check --strict -

A match establishes equality with the repository metadata value. It does not establish safety or catalog-side artifact retrieval.

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5

2022.5-2 / arm64Observed Sep 1, 2026 to Sep 1, 2026

Verification status: Metadata observed; artifact bytes were not independently fetched or hashed by this catalog import. The digest below is source-reported.

Source-reported sha256: db581a969a59b7c52312923848194d13e872b909255291f96d99bc4e87bffb40

After downloading that exact artifact, compare its bytes with the source-reported expected digest:

printf '%s  %s\n' 'db581a969a59b7c52312923848194d13e872b909255291f96d99bc4e87bffb40' 'gromacs_2022.5-2_arm64.deb' | sha256sum --check --strict -

A match establishes equality with the repository metadata value. It does not establish safety or catalog-side artifact retrieval.

Field source: Debian 12 (Bookworm) main arm64 revision bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00

Catalog record completeness

The completeness score measures metadata coverage, not software quality, security, compatibility, or suitability.

Summary and description: 25/25
Artifact path and source digest: 25/25
Dependency metadata: 15/15
Package-file index: 15/15
Homepage: 5/5
License text: 0/5
Source package or maintainer: 10/10

Recorded total: 95/100

Field source: Debian 12 (Bookworm) main amd64 revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5, Debian 12 (Bookworm) main arm64 revision bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00. The cross-OS mapping is catalog-derived from the source-reported homepage; it does not establish authorship or publisher identity

Sources and provenance

Field-source links above resolve here. Each source entry names the metadata publisher, trust tier, exact snapshot revision, signature result, and observation time; catalog-derived mappings are labeled separately.

Debian 12 (Bookworm) main amd64Sep 1, 2026
Authoritative source; repository metadata signature verified, revision bookworm-main-amd64:9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Signature verification covers the configured repository metadata chain. It does not certify that the package is safe or suitable.
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Signed Release → package-index hash linkage
Path: main/binary-amd64/Packages.xz
Expected SHA-256: 9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Observed SHA-256: 9e0b5aabb2465b3d2e7a7fe27f9913846277833f7a2826e7767acccff5b588c5
Result: match verified
Debian 12 (Bookworm) main arm64Sep 1, 2026
Authoritative source; repository metadata signature verified, revision bookworm-main-arm64:2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Signature verification covers the configured repository metadata chain. It does not certify that the package is safe or suitable.
Repository-signature verification record
Signed object
https://deb.debian.org/debian/dists/bookworm/InRelease
Signed-object SHA-256
77737fa4b34f2693e982cc9ee35736816c35a7778fc2d326cc1bbf5b301fe1aa
Signer fingerprint
4CB50190207B4758A3F73A796ED0E7B82643E131
Keyring revision
debian-archive-keyring.gpg
SHA-256 506b815cbb32d9b6066b4a2aa524071e071761e7e7f68c3ac74f3061ba852017
Tool and policy
gpgv (GnuPG) 2.4.9
openfactory-software-catalog-signature-v1
Verification time
Sep 1, 2026
Signed Release → package-index hash linkage
Path: main/binary-arm64/Packages.xz
Expected SHA-256: 2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Observed SHA-256: 2ddb1737692e8c45c53e8d57c0ce4cd21c78c5703b830c3226b1423566a06c00
Result: match verified