DNA as Resonant Engine
This paper explains that DNA and the genetic code instantiate the same tetrad-cycle architectural family developed in the companion resonant-engine and Solar-System papers. At molecular scale, the paper assigns the four…
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CuAAC Glycosylation of Silyl-Protected Alkynes in Aqueous Media
Copper-catalyzed Azide-Alkyne Cycloaddition (CuAAC) “click chemistry” has proven to be a powerful tool in the realm of glycosylation, allowing for efficient attachment of very large carbohydrates to other complex molecu…
Feature Importance and Growth Rate Prediction in SiC PVT Processes through Advanced Machine Learning Models
Silicon carbide is a key wide-bandgap semiconductor material for next-generation power electronics, yet the Physical Vapor Transport (PVT) method used for bulk crystal growth remains constrained by complex thermal-chemi…
A structural accessibility principle for LbuCas13a activation by noncontiguous DNA.
Molecular basis of UV lesion binding and repair inhibition by ETS-family transcription factors.
Liquid-liquid phase separation and a phage-encoded inhibitor cooperatively drive transcriptional transition during phage SPO1 infection.
Identification of the Novel HLA-C*16:248 Allele Using Next-Generation Sequencing.
Toward Mechanistic Interpretability of an AI Foundation Model Fine-Tuned for Atmospheric Chemistry
Weather forecasting foundation models (FMs) are increasingly fine-tuned to predict air quality, offering fast global pollution forecasts at lower computational cost than conventional chemical transport models. These FMs…
Chemical Chain-of-Thought Functions as a Hallucination-Prone Molecular Scratchpad
Chemical reasoning language models are expected to derive molecular answers through faithful chain-of-thought (CoT). However, across four reasoning model families and twelve chemistry tasks, hallucination is widespread …
Efficient classical simulation of large-scale unitary cluster Jastrow circuits
Recent experiments on quantum computers have challenged the limits of classical computation in chemistry, simulating ground states of strongly correlated molecules. Many of these experiments have utilized the unitary cl…
Axel Dieter Becke: Not just the "B" in "B3LYP"
There is hardly anyone doing electronic structure calculations on molecules who has not used the famous B3LYP functional. Many will even know that the "B" in B3LYP stands for Becke, but how many know the history of the …