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The Geometry of Activity Cliffs: Representation Dependence and Multi-Scale Characterization of Activity Landscapes
Announce Type: cross Abstract: Activity cliffs, structurally similar compounds with large potency differences, are widely treated as intrinsic features of chemical datasets. We argue that apart from target biology, much of our cliff understanding is a consequence of the geometry induced by the chosen molecular representation, not a property of a molecule pair itself. We designed a six-step pipeline to systematically test this hypothesis.
The Geometry of Activity Cliffs: Representation Dependence and Multi-Scale Characterization of Activity Landscapes
Announce Type: cross Abstract: Activity cliffs, structurally similar compounds with large potency differences, are widely treated as intrinsic features of chemical datasets. We argue that apart from target biology, much of our cliff understanding is a consequence of the geometry induced by the chosen molecular representation, not a property of a molecule pair itself. We designed a six-step pipeline to systematically test this hypothesis.
The Breakdown | Rugby mourns Spurrell and Slattery, two titans who exemplified the game’s spirit
If you want to understand warrior mentality, look no further than these unflinching icons of the 1970s and 80sPeople talk a lot about character in sport without always agreeing on a precise definition. Hanging in there when times get tough? Arguably that is a pre-requisite across top-level competition.
The Breakdown | Rugby mourns Spurrell and Slattery, two titans who exemplified the game’s spirit
If you want to understand warrior mentality, look no further than these unflinching icons of the 1970s and 80sPeople talk a lot about character in sport without always agreeing on a precise definition. Hanging in there when times get tough? Arguably that is a pre-requisite across top-level competition.
European sentiments towards the US hit an all-time low
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Australian housing market stalls in May
National home values flatline in May for the first time since January 2025 Mon 1 Jun 2026 at 4:57am In short: Australia's housing market stalled in May, with national home values flat after months of slowing growth. The weakness was led by Sydney and Melbourne, where values fell 0.9 per cent and 0.8 per cent respectively, according to Cotality data. While the Reserve Bank is widely expected to hold interest rates steady at its June 15-16 meeting, buyers remain highly sensitive to any signs...
What is a Fata Morgana? Sea mirage sparks queries
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