master · x86_64-linux · cf9005753f89 · generated 2026-10-08T00:45:57Z

pdb2pqr 3.7.1 single

Software for determining titration states, adding missing atoms, and assigning charges/radii to biomolecules

Name
pdb2pqr-3.7.1
Package set
top-level
Homepage
https://www.poissonboltzmann.org/
License
BSD-3-Clause
Source
pkgs/development/python-modules/pdb2pqr/default.nix:61
Derivation
/nix/store/q52sjybwqrhxp3llx12bd9ixw411y117-python3.14-pdb2pqr-3.7.1.drv
Repology
not reported as outdated · look up (as of 2026-10-08T00:43:59Z)

Maintainers 1

HandleNameContactVia
natsukium Tomoya Otabi GitHub · nixpkgs@natsukium.com listed on package

Dependencies 24

PackageAsMaintainersUsed by (transitive)Status
python3 3.14.7 propagatedBuildInputs 72,272 team-only outdated
python314Packages.docutils 0.23 propagatedBuildInputs 44,935 single
python314Packages.mmcif-pdbx 2.1.0 propagatedBuildInputs 2 single
python314Packages.numpy 2.5.2 propagatedBuildInputs 11,434 single outdated
python314Packages.propka 3.5.1 propagatedBuildInputs 2 single
python314Packages.requests 2.34.2 propagatedBuildInputs 43,249 single
ensureNewerSourcesForZipFilesHook 26.05pre-git nativeBuildInputs
74,333 unmaintained setup hook
python313Packages.pythonOutputDistHook 26.05pre-git nativeBuildInputs
74,301 unmaintained setup hook
python313Packages.pythonRemoveBinBytecodeHook 26.05pre-git nativeBuildInputs
74,321 unmaintained setup hook
python314Packages.hatchling 1.31.0 nativeBuildInputs 69,933 maintained outdated
python314Packages.pandas 3.0.4 nativeBuildInputs 6,892 single outdated
python314Packages.pypaBuildHook 26.05pre-git nativeBuildInputs
71,210 unmaintained setup hook
python314Packages.pypaInstallHook 26.05pre-git nativeBuildInputs
71,431 unmaintained setup hook
python314Packages.pytestCheckHook 26.05pre-git nativeBuildInputs
69,812 unmaintained setup hook
python314Packages.pythonCatchConflictsHook 26.05pre-git nativeBuildInputs
71,427 unmaintained setup hook
python314Packages.pythonImportsCheckHook 26.05pre-git nativeBuildInputs
71,452 unmaintained setup hook
python314Packages.pythonNamespacesHook 26.05pre-git nativeBuildInputs
71,450 unmaintained setup hook
python314Packages.pythonRelaxDepsHook 26.05pre-git nativeBuildInputs
71,213 unmaintained setup hook
python314Packages.pythonRemoveTestsDirHook 26.05pre-git nativeBuildInputs
71,450 unmaintained setup hook
python314Packages.pythonRuntimeDepsCheckHook 26.05pre-git nativeBuildInputs
71,399 unmaintained setup hook
python314Packages.testfixtures 10.0.0 nativeBuildInputs 151 single outdated
python314Packages.wrapPython 26.05pre-git nativeBuildInputs
71,456 unmaintained setup hook
bashNonInteractive 5.3p15 other input 102,175 maintained outdated
stdenv 26.05pre-git other input
90,063 team-only

Used by 0 directly, 0 transitively

No package depends on this one.