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Port details
py-molsym Molecular symmetry detection and SALC construction
1.3.0 science Σ=0 search for ports that depend on this port Find issues related to this port Report an issue related to this port View this port on Repology. pkg-fallout Package not present on quarterly.This port was created during this quarter. It will be in the next quarterly branch but not the current one. upstream: 1.3.1A newer version was found upstream by portscout, first on 2026-11-01.
Maintainer: yuri@FreeBSD.org search for ports maintained by this maintainer
Port Added: 2026-10-25 05:46:47
Last Update: 2026-10-25 05:42:24
Commit Hash: b98a5a3
Also Listed In: python
License: MIT
WWW:
https://github.com/NASymmetry/MolSym
Description: #
MolSym is a program for molecular point group detection, symmetry operations, character tables, and the construction of symmetry-adapted linear combinations (SALCs) of internal coordinates and Cartesian displacements.
Homepage    cgit ¦ Codeberg ¦ GitHub ¦ GitLab ¦ SVNWeb - no subversion history for this port
Manual pages: #
FreshPorts has no man page information for this port.
pkg-plist: as obtained via: make generate-plist #
There is no configure plist information for this port.
USE_RC_SUBR (Service Scripts)
  • no SUBR information found for this port
Dependency lines:
  • ${PYTHON_PKGNAMEPREFIX}molsym>0:science/py-molsym@${PY_FLAVOR}
To install the port: #
cd /usr/ports/science/py-molsym/ && make install clean
To add the package, run one of these commands:
  • pkg install science/py-molsym
  • pkg install py312-molsym
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.
NOTE: This is a Python port. Instead of py312-molsym listed in the above command, you can pick from the names under the Packages section.
PKGNAME: py312-molsym
Package flavors (<flavor>: <package>) #
  • py312: py312-molsym
distinfo: #
TIMESTAMP = 1792902093 SHA256 (molsym-1.3.0.tar.gz) = 0df70ec3b0d7804e98808c6d6d7cd4a6b2239ef81acfb9faf3e549996811a833 SIZE (molsym-1.3.0.tar.gz) = 1487631
Packages (timestamps in pop-ups are UTC): #
py312-molsym
ABIaarch64amd64armv6armv7i386
FreeBSD:14:latest1.3.01.3.0--1.3.0
FreeBSD:14:quarterly-----
FreeBSD:15:latest1.3.01.3.0n/a-n/a
FreeBSD:15:quarterly--n/a-n/a
FreeBSD:16:latest1.3.01.3.0n/a-n/a
Dependencies #
NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
Build dependencies: #
  1. py312-setuptools>=63.1.0 : devel/py-setuptools@py312
  2. py312-setuptools-scm>=8 : devel/py-setuptools-scm@py312
  3. py312-wheel>0 : devel/py-wheel@py312
  4. python3.12 : lang/python312
  5. py312-build>=0 : devel/py-build@py312
  6. py312-installer>=0 : devel/py-installer@py312
Test dependencies: #
  1. py312-qcelemental>=0.50.0 : science/py-qcelemental@py312
  2. py312-pytest>=7,1 : devel/py-pytest@py312
  3. python3.12 : lang/python312
Runtime dependencies: #
  1. py312-numpy>=1.23.4 : math/py-numpy@py312
  2. python3.12 : lang/python312
This port is required by: #
for Run #
  1. science/py-pyberny
Configuration Options: #
No options to configure
Options name: #
science_py-molsym
USES: #
python
pkg-message: #
FreshPorts was unable to extract/find any pkg message
Master Sites: #
Expand this list (2 items)
Collapse this list.
  1. https://files.pythonhosted.org/packages/source/m/molsym/
  2. https://pypi.org/packages/source/m/molsym/
Collapse this list.

Number of commits found: 1 #

Commit History - (may be incomplete: for full details, see links to repositories near top of page)
CommitCreditsLog message
1.3.0
25 Oct 2026 05:42:24
commit hash: b98a5a3717581f9aa4fba7b3d46020d4194068dacommit hash: b98a5a3717581f9aa4fba7b3d46020d4194068dacommit hash: b98a5a3717581f9aa4fba7b3d46020d4194068dacommit hash: b98a5a3717581f9aa4fba7b3d46020d4194068da files touched by this commit		 Yuri Victorovich (yuri) search for other commits by this committer 
science/py-molsym: New port: Molecular symmetry detection and SALC construction

Approved by:	no need for approval according to bapt@

Number of commits found: 1

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