Results 261 to 270 of about 3,270,734 (378)

Macrocyclic control of electron transfer to high valent uranium in heterobimetallic complexes.

Dalton Trans
Kumar A, Golwankar RR, Pyrch MMF, Cooper FL, Arehart GA, Carter KP, Oliver AG, Day VW, Forbes TZ, Blakemore JD.   +9 more
europepmc   +1 more source

Clarification of Some Bonding Concepts: Virial Theorem, Electron Pair Repulsion, and Rotational Barriers. [PDF]

J Comput Chem
Schwarz WHE, Frenking G, Pan S.
europepmc   +1 more source

Design and validation of a novel dosimetry phantom for motion management audits

Journal of Applied Clinical Medical Physics, EarlyView.
Abstract Background We present a novel phantom design for conducting end‐to‐end dosimetry audits for respiratory motion management of two anatomical treatment sites. The design enables radiochromic film measurements of the dose administered to the target throughout the respiratory cycle (motion‐included) and the dose delivered to the time‐averaged ...
Alex Burton, Sabeena Beveridge, Nicholas Hardcastle, Silvio Malfitana, Janaka Madamperuma, Rick Franich   +5 more
wiley   +1 more source

Interpretable machine learning models classify minerals via spectroscopy. [PDF]

Sci Rep
Smith R, Spano TL, McDonnell M, Drane L, Gibbs I, Miskowiec A, Niedziela JL, Shields AE.   +7 more
europepmc   +1 more source

Empowering young minds through STEM education: Engaging high schoolers in Ghana through medical physics

Journal of Applied Clinical Medical Physics, EarlyView.
Abstract Purpose To promote diversity in Science, Technology, Engineering, and Mathematics (STEM), an educational presentation and hands‐on session was organised to raise awareness of STEM career opportunities among high school girls to introduce the students to the field of medical physics. Materials and Methods The study involved 65 first‐year Senior
Afua A. Yorke, Mercy T. Schandorf, Abigail N. M. Quaye, Peniel Tenkorama Twum, Bishwambhar Sengupta, Kwadwo Nkansah‐Poku, Juliana A. Kplorfia, Jessica Fagestrom   +7 more
wiley   +1 more source

Correction to "The Melamine-Driven Solvation Effect Promotes Oxygen Reduction on Platinum Catalyst: Machine Learning-Aided Free Energy Calculations". [PDF]

J Phys Chem Lett
Jinnouchi R, Minami S.
europepmc   +1 more source

Computational Chemistry for Nuclear Waste Characterization and Processing: Relativistic Quantum Chemistry of Actinides

, 2002
Robert J. Harrison, David E. Bernholdt, Bruce E. Bursten, Wibe A. de Jong, David A. Dixon, Kenneth G. Dyall, Walter V Ermler, George I. Fann, Phillipa Hay, Nina Ismail Buchner, Ricky A. Kendall, Jun Li, M. M. Marino, Colin J. Marsden, Richard L. Martin, Michael Minkoff, Jeffrey A. Nichols, Jarek Nieplocha, Russell M. Pitzer, Lawrence R. Pratt, Hans Georg Schreckenbach, Michael Seth, Ron Shepard, Rick Stevens, Jeffrey L. Tilson, Albert F. Wagner, Qi Wang, Theresa L. Windus, Adrian T. Wong, Zhiyong Zhang   +29 more
openalex   +1 more source

Mitochondrial DNA disorders in neuromuscular diseases in diverse populations

Annals of Clinical and Translational Neurology, EarlyView.
Abstract Neuromuscular features are common in mitochondrial DNA (mtDNA) disorders. The genetic architecture of mtDNA disorders in diverse populations is poorly understood. We analysed mtDNA variants from whole‐exome sequencing data in neuromuscular patients from South Africa, Brazil, India, Turkey and Zambia. In 998 individuals, there were two definite
Fei Gao, Katherine R Schon, Jana Vandrovcova, Özlem Yayıcı Köken, Sharika Raga, Kireshnee Naidu, Maryke Schoonen, Nimita Rani, Pedro Tomaselli, Dipti Baskar, Musambo Kapapa, Ipek Polat, Lindsay A Wilson, Kumarasamy Thangaraj, Uluç Yiş, Bevinahalli N Nandeesh, David Bearden, Michelle Kvalsund, Franclo Henning, Seena Vengalil, Atchayaram Nalini, Claudia F. R. Sobreira, Wilson Marques, Haluk Topoloğlu, Michael G Hanna, Sireesha Yareeda, Venugopalan Y Vishnu, Francois H van der Westhuizen, Izelle Smuts, Surita Meldau, Jo Wilmshurst, Büşranur Çavdarlı, Jeannine Heckmann, Patrick F Chinnery, Rita Horvath   +34 more
wiley   +1 more source

Optimizing Computational Parameters for Nuclear Electronic Orbital Density Functional Theory: A Benchmark Study on Proton Affinities. [PDF]

J Comput Chem
Khan RU, Tonner-Zech R.
europepmc   +1 more source

Electron-nuclear double resonance spectroscopy (and electron spin-echo envelope modulation spectroscopy) in bioinorganic chemistry

, 2003
Brian M. Hoffman
openalex   +1 more source