Results 71 to 80 of about 25,493,345 (238)

Quantum‐Trained AI Enables Inverse Design of Organic Frontier Orbitals at Billion‐Scale

Advanced Science, EarlyView.
Quantum‐trained AI links molecular substructures to frontier‐orbital energetics and enables interpretable screening across nearly one billion GDB‐13 molecules. By combining fragment‐ and ring‐level insights with donor–acceptor energy alignment against ITIC, the framework narrows an immense chemical space to a small set of promising candidates and ...
Yeongnam Ko, Se Jin Kim, Ki Chul Kim
wiley   +1 more source

CIAO: Chandra’s Data Analysis System for X-Ray Astronomy and Beyond

The Astrophysical Journal
The Chandra Interactive Analysis of Observations (CIAO) software, developed by the Chandra X-ray Center, has been the data analysis package for the Chandra X-ray Observatory since its launch in 1999. Over nearly three decades, CIAO has grown from a small
Antonella Fruscione, Jonathan C. McDowell, Douglas J. Burke, Mark Cresitello-Dittmar, Ian N. Evans, Janet D. Evans, Kenny Glotfelty, Hans Moritz Günther, David Huenemoerder, William Joye, Nicholas P. Lee, Warren McLaughlin, Joseph B. Miller, Melania Nynka, David A. Principe, Aneta Siemiginowska   +15 more
doaj   +1 more source

Interactive Hierarchical Data Investigation using Abstractions -- the Waltz Visualization Environment [PDF]

, 1996
Scientific visualization is becoming common in the work-place; hastened by the growth in the power of computers generating data that needs to be visualized.
Roberts, Jonathan C.
core  

Emergent Magnetism, Heavy Electrons, and Pressure‐Induced Reentrant Superconductivity in the Iron Substituted 4d Transition‐Metal Sulfides

Advanced Science, EarlyView.
This work illustrates that magnetic Fe substitution enables systematic modulation of physical properties of the putative unconventional superconductor Rh17S15. Iron doping uncovers delicate competition between weak ferromagnetism, spin‐glass states, heavy‐fermion signatures, and superconductivity.
Yalei Huang, Lu Xin, Na Zuo, Bin Li, Wei Zhou, Dhanarajagopal Alltrin, Boning Yu, Haiyang Yang, Bin Qian, Wen‐Chin Lin, Raman Sankar, Michael Smidman, Xiangzhuo Xing, Chunqiang Xu, Xiaobing Liu, Jianhui Dai, Dong Qian, Shiyan Li, Xiaofeng Xu   +18 more
wiley   +1 more source

Astronomy & Astrophysics (CAUCASUS)-VOLUME 4

, 2018
The IV volume of Journal “Astronomy & Astrophysics (Caucasus)” was dedicated to the 110th Anniversary of Academician Victor Hambardzumyan. AcademicianVictor Hambardzumyan President of International Union of Astronomy (in 1961 – 1964 and 1966 – 72 ...
(CAUCASUS), Astronomy & Astrophysics
core   +1 more source

Exoplanet Classification Through Vision Transformers with Temporal Image Analysis

The Astronomical Journal
The classification of exoplanets has been a longstanding challenge in astronomy, requiring significant computational and observational resources. Traditional methods demand substantial effort, time, and cost, highlighting the need for advanced machine ...
Anupma Choudhary, Sohith Bandari, B. S. Kushvah, C. Swastik   +3 more
doaj   +1 more source

Tau Aggregate Imaging and Transcriptomics of Alzheimer's Disease Brain at Different Stages of Disease

Advanced Science, EarlyView.
The protein aggregates and gene expression in the middle temporal gyrus (MTG) and somatosensory cortex (SOM) of the postmortem brains of 13 Alzheimer's disease patients were studied in detail, revealing that small hyperphosphorylated tau aggregates increase with Braak stage driven by microglial inflammation.
Elizabeth A. English, Dorothea Böken, Matthew W. Cotton, Matthew R. Cheetham, Johanna S. Jackson, Georg Meisl, John S. H. Danial, Paul M. Matthews, Nurun N. Fancy, David Klenerman   +9 more
wiley   +1 more source

EMDialog : bringing information visualization into the museum [PDF]

, 2015
Digital interactive information displays are becoming more common in public spaces such as museums, galleries, and libraries. However, the public nature of these locations requires special considerations concerning the design of information visualization
Schmidt, Holly, Hinrichs, Uta, Carpendale, Sheelagh   +2 more
core   +1 more source

Space Jam‐Ming: Generating Interstitial Space Using Fragmented Granular GelMA to Investigate Novel Paradigms of Cancer Metastasis

Advanced Science, EarlyView.
Microgels enable independent control of stiffness and interstitial space, overcoming limitations of conventional 3D hydrogels. Using fragmented gelatin methacryloyl microgels, we show that stiffness does not restrict non‐metastatic breast cancer growth, contrary to bulk hydrogels, and reveal the role of adherent‐to‐suspension transition in cancer ...
Danielle Vahala, Zhuang Min Lee, Sebastian E. Amos, Dong Woo Son, Jong Hwa Byun, Farzan Navaeipour, Jiayue Li, Kai L. Metzner, Ji Hoon Jeong, Juyeon Kim, Yongsung Hwang, Brendan F. Kennedy, Khoon S. Lim, Hee Seung Lee, Hyun Woo Park, Yu Suk Choi   +15 more
wiley   +1 more source

WGM Single‐Molecule Validation of pH‐Dependent Molecular Energetics at Gold Nanointerfaces: Influence of Buffer Molecules on Glyphosate Ligand Binding

Advanced Science, EarlyView.
Single‐molecule optical sensing reveals how pH and buffer molecules regulate glyphosate interactions with gold nanorods. Combined experiments and theoretical calculations show that changes in molecular charge and competition from buffer species determine whether glyphosate binds transiently or persistently.
Kulathunga Mudalige Kalani Perera, Srikanth Pedireddy, Sivaraman Subramanian, Frank Vollmer   +3 more
wiley   +1 more source