ArticleJournal of chemical information and modeling2025
Hypershape Recognition: A General Framework for Moment-Based Molecular Similarity.
Article in Journal of chemical information and modeling, 2025. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 2 papers.
What it found
Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.
The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
The trial behind it
Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.
Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.
Who cites it
2 citing papers in PubMed.
- 3DOpt: Benchmark for Automated Design of 3D Molecular Structures across the Periodic Table.Journal of chemical information and modeling · 2026Article
- Determining molecular structure, coordination geometry, and molecular symmetry using a continuous symmetry operation measure software.Nature communications · 2025Article
Corrections and comments
PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.
Authors and funding
4 authors.
Funding
No grant is acknowledged in the PubMed record.
Abstract
Due to the widespread use of molecular similarity assessments in drug design, numerous methods for the calculation of similarity scores of organic molecules have been developed. When applied to other types of molecules, such as inorganic and organometallic compounds, these methods face significant challenges. To overcome these challenges, we here introduce Hypershape Recognition (HSR), a versatile framework for moment-based similarity assessment of three-dimensional (3D) chemical representations annotated with atomic features. In a default, general-purpose, implementation of the framework, features containing information about the atomic number, the isotope (the number of neutrons), and the formal charge of each atom are combined with its Cartesian coordinates to form the
Indexed as
Identifiers
What OpenQuestion holds
Registered trials
Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.