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Ran 01 Aug 2022 07:02PM UTC

Files 24

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Committed 01 Aug 2022 07:02PM UTC coverage: 92.741%. Remained the same

Job # #259.1

Build Type

push

coveralls-python

Committed by

web-flow

Commit Message

V1.2.2 (#92)

* Trying out CI build for python 3.10.

* Trying out installation without pytorch dev dependency.

* Fixed linting.

* Updated version number.

* Fixed permutation issues and changed sorting algorithm when sorting Coulomb matrix.

* Added identical stable sorting for Ewald and Sine matrices as is used in Coulomb matrix, fixed tests.

* Fixed linting.

* Fixing test issue.

* Updated sphinx config to support newer sphinx version and the rtd theme.

* Fixed issue in testing the examples.

* Documentation update.

* Renamed rcut->r_cut, nmax->n_max, lmax->l_max to keep parameter naming more consistent. The old names still work as well.

* Fixed linting.

* Fixed variable naming in EwaldSumMatrix.

* Updated changelog.

* Fixed test accuracy issue.

* Fixed test accuracy issue.

Coverage Stats

2389 of 2576 relevant lines covered (92.74%)

0.93 hits per line

SINGROUP / dscribe / #259 / 1
91%
master: 91%

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SINGROUP / dscribe / #259 / 1 91% master: 91%

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SINGROUP / dscribe / #259 / 1
91%
master: 91%

README BADGES
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