`mol.calculate()` should ignore cache when energy model parameters change #93

avirshup · 2016-08-28T22:58:23Z

This is a small view of the much larger issue of calculation caching. This is dependent on good semantic storage of calculation results, plus a way to determine whether two calculation descriptions are equivalent or not.

avirshup added the bug label Aug 28, 2016

avirshup self-assigned this Oct 19, 2016

avirshup added the enhancement label Oct 19, 2016

avirshup removed the enhancement label Jun 9, 2017

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`mol.calculate()` should ignore cache when energy model parameters change #93

`mol.calculate()` should ignore cache when energy model parameters change #93

avirshup commented Aug 28, 2016 •

edited

mol.calculate() should ignore cache when energy model parameters change #93

mol.calculate() should ignore cache when energy model parameters change #93

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avirshup commented Aug 28, 2016 • edited

`mol.calculate()` should ignore cache when energy model parameters change #93

`mol.calculate()` should ignore cache when energy model parameters change #93

avirshup commented Aug 28, 2016 •

edited