BSD Portsscience/numsa 0.2.0 FreeBSD
Solvent accessible surface area calculation
- System
- FreeBSD
- Repository
- FreeBSD ports
- Maintainer
- [email protected]
- License
- LGPL3+
- Categories
- science
- Package size
- 130.0 KiB, 284.3 KiB installed
Description
Numerical surface area integrator for molecular inputs. This project is based on routines from xtb and dftb+.
Install
Binary package:
pkg install numsaFrom the ports tree:
cd /usr/ports/science/numsa/ && make install cleanTo depend on this port in another port's Makefile:
RUN_DEPENDS= numsa>0:science/numsa
LIB_DEPENDS= libnumsa.so:science/numsaPackages
The version each package repository carries. “-” means the repository builds no package of it, “n/a” that there is no such repository.
| Repository | aarch64 | amd64 | armv6 | armv7 | i386 |
|---|---|---|---|---|---|
| FreeBSD:14:latest | 0.2.0 | 0.2.0 | - | - | 0.2.0 |
| FreeBSD:14:quarterly | 0.2.0 | 0.2.0 | n/a | - | 0.2.0 |
| FreeBSD:15:latest | 0.2.0 | 0.2.0 | n/a | - | - |
| FreeBSD:15:quarterly | 0.2.0 | 0.2.0 | n/a | n/a | n/a |
| FreeBSD:16:latest | 0.2.0 | 0.2.0 | n/a | n/a | n/a |
| FreeBSD:16:quarterly | n/a | n/a | n/a | n/a | n/a |
Dependencies
As this port's Makefile names them.
Library 1
libmctc-lib.so: science/mctc-lib
Test 1
test-drive>0: devel/test-drive
The full lists below include those, and their dependencies in turn.
Build dependencies 20
Run dependencies 11
Required by 1
Configuration
No options to configure.
- USES
- blaslapack cmake fortran tar:xz
- Service scripts
- none
Files
pkg-plist 24
- bin/numsa-exe
- include/numsa/numsa.mod
- include/numsa/numsa_data.mod
- include/numsa/numsa_lebedev.mod
- include/numsa/numsa_output.mod
- include/numsa/numsa_search.mod
- include/numsa/numsa_surface.mod
- include/numsa/numsa_version.mod
- include/numsa/smd.mod
- include/numsa/smd_cds.mod
- include/numsa/smd_init.mod
- include/numsa/smd_io.mod
- include/numsa/smd_output.mod
- include/numsa/smd_sigma.mod
- lib/cmake/numsa/Findmctc-lib.cmake
- lib/cmake/numsa/Findtest-drive.cmake
- lib/cmake/numsa/numsa-config-version.cmake
- lib/cmake/numsa/numsa-config.cmake
- lib/cmake/numsa/numsa-targets-.cmake
- lib/cmake/numsa/numsa-targets.cmake
- lib/cmake/numsa/numsa-utils.cmake
- lib/libnumsa.so
- lib/libnumsa.so.0
- lib/libnumsa.so.0.2.0
distinfo 1
| File | Size | SHA256 |
|---|---|---|
| numsa-0.2.0.tar.xz | 1.516116e+06 | 3e20cefb3747627876cc6c6750bf74692e35b81c059580dd3bd75333f9b7c089 |
Master sites 1
- https://github.com/grimme-lab/numsa/releases/download/v0.2.0/
Commit history 0
No commits in the history this site was built from.