Results 271 to 280 of about 1,299,441 (381)

Data‐Driven Polyoxometalate Chemistry

open access: yesChemistry – A European Journal, EarlyView.
An integrative data‐driven approach leveraging AI, computations, and robotic experimentation enables accelerated discovery of polyoxometalates, bridging synthetic unpredictability and paving the way for rational, predictive, and functional cluster chemistry.
Aleksandar Kondinski   +4 more
wiley   +1 more source

Visualizing dynamics of charges and strings in (2 + 1)D lattice gauge theories. [PDF]

open access: yesNature
Cochran TA   +189 more
europepmc   +1 more source

MS2DECIDE: Aggregating Multiannotated Tandem Mass Spectrometry Data with Decision Theory Enhances Natural Products Prioritization

open access: yesChemistry–Methods, EarlyView.
Tandem mass spectrum to decision (MS2DECIDE) leverages decision theory and expert knowledge to aggregate the outputs of three widely used annotation tools (GNPS, Sirius, and ISDB‐LOTUS) and compute a recommendation for targeting natural products with regard to their potential novelty.
Yassine Mejri   +7 more
wiley   +1 more source

String field theory around the tachyon vacuum [PDF]

open access: bronze, 2001
Leonardo Rastelli   +2 more
openalex   +1 more source

Supplementing Single‐Arm Trials with External Control Arms—Evaluation of German Real‐World Data

open access: yesClinical Pharmacology &Therapeutics, EarlyView.
As single‐arm trials (SATs) are increasingly used in pharmaceutical research, the validity of such study designs needs to be critically assessed. We characterize the feasibility of supplementing SATs with real‐world data (RWD)‐derived external control arms by determining the proportion of SATs on breast cancer and amyotrophic lateral sclerosis (ALS ...
Martin Russek   +2 more
wiley   +1 more source

Semi‐Automated Pipeline for Transition State Search of Molecular Photoswitches

open access: yesChemPhotoChem, EarlyView.
A semi‐automated pipeline for the transition state search of molecular switches (PiTS3) is reported, which facilitates the search, optimization, and conformational analysis of transition states of photochemical switches based on the stilbene, imine, aza‐diarylethene, and norbornadiene structures.
Roman Yu. Peshkov   +2 more
wiley   +1 more source

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