pub_soft/apbs

mirror of https://github.com/Electrostatics/apbs.git synced 2026-06-04 12:44:23 +08:00

Files

History

Noah Oblath 6ddced8889 Min and max python versions

2021-12-23 02:53:13 -08:00

..

apbs_check_forces.py

De-linting.

2021-06-14 09:31:38 -07:00

apbs_check_intermediate_energies.py

De-linting.

2021-06-14 09:31:38 -07:00

apbs_check_results.py

Fixed flake8 and black warnings

2020-08-25 13:02:48 -07:00

apbs_logger.py

Replaced msms with skin and fixed GCC 10 errors

2020-08-25 12:43:53 -07:00

apbs_tester.py

De-linting.

2021-06-14 09:31:38 -07:00

CMakeLists.txt

Min and max python versions

2021-12-23 02:53:13 -08:00

README.md

Redirect user to readthedocs

2020-12-16 15:59:32 -08:00

test_cases.cfg

Turn PYGBE on, and a couple of associated fixes

2021-12-06 14:04:58 -08:00

README.md

APBS validation and test cases

Please see tests cases