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Extracted `[y.name for y in ...components]` into `set` comprehensions outside the loop over `x` elements to prevent recalculating the lookup list on every iteration, changing `O(N*M)` complexity to near `O(N+M)`. Co-authored-by: akutuva21 <44119804+akutuva21@users.noreply.github.com>
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Superseded by #26 bnglWriter membership optimization. |
Understood. Acknowledging that this work is superseded and stopping work on this task. |
💡 What: Replaced the list comprehensions
[y.name for y in pMolecule.components]and[y.name for y in rMolecule.components]used for inner loop membership testing with pre-computed setspMolecule_component_namesandrMolecule_component_names.🎯 Why: The list comprehensions were inside a list comprehension for
x, resulting in them being evaluatedO(N)times inside the nested loops, causingO(N * M)complexity whereNandMare the counts of components inrMoleculeandpMolecule. By using sets initialized prior to the loop, it converts membership testing toO(1)operations and requires computing the lists of names only once.📊 Measured Improvement:
PR created automatically by Jules for task 18005947991239207498 started by @akutuva21