| Port details |
- numsa Solvent accessible surface area calculation
- 0.2.0 science
 =1      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. - Maintainer: alven@FreeBSD.org
- Port Added: 2025-11-03 12:57:07
- Last Update: 2025-11-03 12:53:56
- Commit Hash: b885b76
- People watching this port, also watch:: tatuin, gladtex, hs-hledger-web, horizon-eda, qelectrotech
- License: LGPL3+
- WWW:
- https://github.com/grimme-lab/numsa/
- Description:
- Numerical surface area integrator for molecular inputs. This project is based on
routines from xtb and dftb+.
  ¦  ¦  ¦  ¦ 
- Manual pages:
- FreshPorts has no man page information for this port.
- pkg-plist: as obtained via:
make generate-plist - USE_RC_SUBR (Service Scripts)
- no SUBR information found for this port
- Dependency lines:
-
- To install the port:
- cd /usr/ports/science/numsa/ && make install clean
- To add the package, run one of these commands:
- pkg install science/numsa
- pkg install numsa
NOTE: If this package has multiple flavors (see below), then use one of them instead of the name specified above.- PKGNAME: numsa
- Flavors: there is no flavor information for this port.
- distinfo:
- TIMESTAMP = 1762114720
SHA256 (numsa-0.2.0.tar.xz) = 3e20cefb3747627876cc6c6750bf74692e35b81c059580dd3bd75333f9b7c089
SIZE (numsa-0.2.0.tar.xz) = 1516116
Packages (timestamps in pop-ups are UTC):
- Dependencies
- NOTE: FreshPorts displays only information on required and default dependencies. Optional dependencies are not covered.
- Build dependencies:
-
- cmake : devel/cmake-core
- gfortran13 : lang/gcc13
- as : devel/binutils
- Test dependencies:
-
- test-drive>0 : devel/test-drive
- Runtime dependencies:
-
- gfortran13 : lang/gcc13
- Library dependencies:
-
- libmctc-lib.so : science/mctc-lib
- libblas.so : math/blas
- liblapack.so : math/lapack
- This port is required by:
- for Libraries
-
- science/cpcmx
Configuration Options:- No options to configure
- Options name:
- science_numsa
- USES:
- blaslapack cmake fortran tar:xz
- FreshPorts was unable to extract/find any pkg message
- Master Sites:
|
Number of commits found: 1
| Commit History - (may be incomplete: for full details, see links to repositories near top of page) |
| Commit | Credits | Log message |
|---|
0.2.0
03 Nov 2025 12:53:56
 |
Älven (alven) |
science/numsa: [NEW PORT] Solvent accessible surface area calculation
Numerical surface area integrator for molecular inputs. This project
is based on routines from xtb and dftb+.
WWW: https://github.com/grimme-lab/numsa/
Reviewed by: diizzy@
Approved by: yuri@ (Mentor)
Differential Revision: https://reviews.freebsd.org/D53529 |
Number of commits found: 1
|
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