chrisjsewell / aiida-crystal17
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451

Pull #7

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improve fractional <-> cartesian conversion

use efficient numpy functions
Pull Request #7: Gulp fixes

298 of 298 new or added lines in 25 files covered. (100.0%)

3452 of 4117 relevant lines covered (83.85%)

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Builds Branch Commit Type Ran Committer Via Coverage
451 gulp-fixes improve fractional <-> cartesian conversion use efficient numpy functions Pull #7 web-flow travis-ci pending completion  
450 gulp-fixes improve fractional <-> cartesian conversion use efficient numpy functions push chrisjsewell travis-ci pending completion  
449 gulp-fixes use kinds from input structure, in `gulp.optimize` parser push chrisjsewell travis-ci pending completion  
448 gulp-fixes fix tests push chrisjsewell travis-ci pending completion  
446 gulp-fixes improve crstal17.main error reporting, and add tests added lots more error codes, and the parser maps the error messages, extracted from the CRYSTAL output file, to the most appropriate one push chrisjsewell travis-ci pending completion  
445 gulp-fixes move raw file content parsers to a submodule To make it more obvious what is the aiida Parser plugin push chrisjsewell travis-ci pending completion  
444 gulp-fixes move pytest timeout to configuration file push chrisjsewell travis-ci pending completion  
443 gulp-fixes update readme conda install push chrisjsewell travis-ci pending completion  
442 gulp-fixes update conda installation command push chrisjsewell travis-ci pending completion  
441 gulp-fixes don't retrieve input file (since it is already stored in CalcJob repo) push chrisjsewell travis-ci pending completion  
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