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Pull the revo_property branch into master#147

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SamikBose wants to merge 7 commits intomasterfrom
revo_property
Open

Pull the revo_property branch into master#147
SamikBose wants to merge 7 commits intomasterfrom
revo_property

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@SamikBose
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  1. A new Projector class with tica-based projector, can be extended to vampnets etc. any method that can transform a high dimensional feature space to a reduced kinetically/mechanistically 'important' space.
  2. A new distance metric to use the tica components to drive the sampling.
  3. A new Projection resampler to resample using a particular tica-coordinate (more direct sampling, yet to be fully tested)

@SamikBose SamikBose requested a review from alexrd March 10, 2026 22:14
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