6223398001
98%

Ran 18 Sep 2023 01:49PM UTC

Jobs 1

Files 38

Run time 2s

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Committed 18 Sep 2023 01:42PM UTC coverage: 98.234%. Remained the same

Build # 6223398001

Build Type

push

github

Committed by

web-flow

Commit Message

Add code for creating initial datasets via brute force (#101)

* Create new steps in the set up

- Gathering the search space
- Building an initial dataset

* Add notebook for getting search spaces from MDF

* Eliminate duplicates

* Add run script for generating initial training sets

* Made write frequency an option

* Switch to using Colmena

Should enable better scaling

* Add a full-scale Theta configuration

* Improve scaling

1. Do not write to disk as often
2. Use Redis instead of file proxies
3.

* Add some analysis plots

* Add polaris configurations, update column order

Run Details

1724 of 1755 relevant lines covered (98.23%)

0.98 hits per line

Jobs

ID	Job ID	Ran	Files	Coverage
1	6223398001.1	18 Sep 2023 01:49PM UTC	38	98.23

exalearn / ExaMol / 6223398001
98%

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exalearn / ExaMol / 6223398001 98%

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