basic.select method can be faster when element
is diferent from 'atom' and syntax='MolSysMT'
#110
Labels
optimization
About speeding up the library
When a selection is done with
element
different from 'atom' over a molecular system with a foreign form, multiple conversions are executed and can be avoided. For instance:element
indices filter needs another conversion to 'molsysmt.Topology'.mask
is used, another conversion to 'molsysmt.Topology' is required.The process can be optimized with a single conversion in case
syntax='MolSysMT'
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