Accurate extraction of molecular representations is a critical step in the drug discovery process. In recent years, significant progress has been made in molecular representation learning methods, ...

SAN FRANCISCO, June 20, 2025 (GLOBE NEWSWIRE) -- Structure Therapeutics Inc. (NASDAQ: GPCR), a clinical-stage global biopharmaceutical company developing novel oral small molecule therapeutics for ...

The structure, which has 2.8-Å resolution according to standard criteria, differs qualitatively from all previously described Aβ fibril structures, both in its molecular conformations and its ...

In a study published in Cell Research, a research team has, for the first time, resolved the high-resolution in situ structure of the central apparatus (CA) within the axoneme of mammalian sperm.

The surprise discovery of a huge cloud of molecular gas — the stuff that forms stars — just 300 light-years away is opening up new ways to study the conditions that enable star birth.

Neo-1 is the first model to unify de novo molecular generation and atomic-level structure prediction in a single model, by generating latent representations of whole molecules instead of ...

Glass Lewis concludes that the Rio Tinto Board has fallen short of investor expectations on this occasion and failed to deliver a “ fulsome response or defence ” against Palliser’s proposal ...

Chemists created three different-size cyclodextrins using ʟ⁠-⁠glucose, whose molecular geometry is the mirror image of that of naturally occurring ᴅ⁠-⁠glucose (Nat. Synth. 2024, DOI: 10 ...

Another is to map a protein’s 3D structure and—with a dose of physics—predict how it can grab onto other molecules. While AlphaFold 2 mostly used an evolutionary approach—training the AI on what we ...

Learn to predict molecular shapes using VSEPR theory for better chemical engineering outcomes. Understand electron pair repulsion and its impact on molecular geometry.

Discussions on ground-state cluster structures can be traced back to 1938 when theoretical physicists, through the analysis of binding energies in α-conjugate nuclei, suggested the possible existence ...