Results 41 to 50 of about 1,626,345 (289)

Ab initio molecular simulations with numeric atom-centered orbitals

Computer Physics Communications, 2009
We describe a complete set of algorithms for ab initio molecular simulations based on numerically tabulated atom-centered orbitals (NAOs) to capture a wide range of molecular and materials properties from quantum-mechanical first principles.
V. Blum, Ralf Gehrke, F. Hanke, P. Havu, V. Havu, X. Ren, K. Reuter, M. Scheffler   +7 more
semanticscholar   +1 more source

Therapeutic Apheresis in Nigeria: A Multi‐Center Summary of Abstracts From the Inaugural Nigerian Society for Apheresis Scientific Meeting

Therapeutic Apheresis and Dialysis, EarlyView.
ABSTRACT Background Therapeutic apheresis (TA) is an established treatment modality for hematologic, neurologic, and immunologic disorders, yet access remains severely limited in sub‐Saharan Africa. Donor apheresis, including platelet apheresis collection from healthy donors, represents an important complementary modality supporting blood product ...
Nosa Bazuaye, Chimezie Okwuonu, Evelyn Idam, Folasade Adelekan‐Popoola, Shakirat Gold‐Olufadi, Olufunto Olufela Kalejaiye, Abdullateef Ogala, Zinnah Aloziem, Blossom Amamchukwu, Patience Elimia, Mkpoikanabasi Obot‐Obot, Henry Mbakwe, Praises Maduagwuna, Olatunji Akinrodoye, Chiamaka Anyanwu, Benjamin Anyanwu, Adedamola Akinsiku, Oluwatoyin A. Akinsiku, Muzamil O. Hassan, Fatiu A. Arogundade, Olalekan E. Ojo, Homayemem Weli, Jesupelumi Adenihun, Aderemi Adelaja, Ebun Bamgboye, Olalekan Olatise, Ade E. Faponle, Ayoola Odeyemi, Michael Muoka, Stephen Asaolu, Qudrat Busari, Blessing Dawudu, Michael Naiyeju, Rasheed A. Balogun   +33 more
wiley   +1 more source

Comparative Study on Antibacterial Efficacy, Hydroxyapatite Crystal, Fluoride Release and Microleakage in Bioactive Restorative Materials

Journal of Pharmacy and Bioallied Sciences
Background: The newer concept of A-BA is gaining more and more attention as newer smart dental material helps in rebuilding demineralized dentin. Aim: To evaluate ABE, HA-CG, FR, and ML in BA restorative material.
Sonali Waghmode, Ranu S. Ingole, Savita Hadakar, Prajakta Gaikwad, Ajay Kumar Dogra, Suman Gulia   +5 more
doaj   +1 more source

Forecasting the Dialysis Burden in Japan: Validation‐Based Projections of Prevalence and Incidence Through 2050

Therapeutic Apheresis and Dialysis, EarlyView.
ABSTRACT Background Japan has one of the highest dialysis prevalence rates worldwide and a shrinking, aging population. Whether dialysis burden has entered a sustained post‐peak phase or whether recent declines partly reflect pandemic‐related disruptions remains uncertain.
Hatice Şahin, Berrak Itır Aylı, Nüket Paksoy   +2 more
wiley   +1 more source

Arap Baharı Sonrası Avrupa Birliği'nin Yeni Komşuluk Politikasi

Mukaddime, 2018
Özet Orta Doğu ve Kuzey Afrika’da 2010 yılında ortaya çıkan halk isyan dalgaları, AB’nin Güney Akdeniz ülkeleriyle ilişkilerini komşuluk politikası bağlamında yeniden düzenlemesine neden olmuştur.
Zelal Başak Kızılkan
doaj   +1 more source

Structural insights into an engineered feruloyl esterase with improved MHET degrading properties

FEBS Letters, EarlyView.
A feruloyl esterase was engineered to mimic key features of MHETase, enhancing the degradation of PET oligomers. Structural and computational analysis reveal how a point mutation stabilizes the active site and reshapes the binding cleft, expading substrate scope.
Panagiota Karampa, Konstantinos Makryniotis, Theofani‐Iosifina Sousani, Evangelos Topakas, Vangelis Daskalakis, Maria Dimarogona   +5 more
wiley   +1 more source

AN OVERVIEW TO TURKEY-EU RELATIONS DURING THE JUSTICE AND DEVELOPMENT PARTY PERIOD

SDÜ Vizyoner Dergisi, 2019
The Turkey–EU relations, which started in 1959, had passed through several important processes until today. Having achieved the status of a “candidate country” at the 1999 Helsinki Summit, Turkey started to make reforms to join the EU on 3 November 2002,
Selim Kanat, İdris Turan, Ekrem Yaşar Akçay   +2 more
doaj   +1 more source

An isoform of 14‐3‐3 protein regulates transbilayer lipid movement at the plasma membrane

FEBS Letters, EarlyView.
Loss of 14‐3‐3ζ in CHO cells confers resistance to exogenous phosphatidylserine (PS) and impairs endocytosis‐independent inward flip‐flop of fluorescent PS at the plasma membrane. RNAi‐mediated knockdown reproduces this defect, while no additive effect is seen in ATP11C‐deficient cells.
Akiko Yamaji‐Hasegawa, Akira Hattori, Masafumi Tsujimoto, Toshihide Kobayashi   +3 more
wiley   +1 more source

Exposure to CuO Nanoparticles Mediates NFκB Activation and Enhances Amyloid Precursor Protein Expression

Biomedicines, 2020
Amyloid precursor protein (APP) is directly related to Aβ amyloidosis—a hallmark of Alzheimer’s disease (AD). However, the impact of environmental factors upon APP biology and Aβ amyloid pathology have not been well studied.
Xiaoyang Mou, Alexander Pilozzi, Breeya Tailor, Jing Yi, Catherine Cahill, Jack Rogers, Xudong Huang   +6 more
doaj   +1 more source

Ab Initio Nonadiabatic Quantum Molecular Dynamics.

Chemical Reviews, 2018
The Born-Oppenheimer approximation underlies much of chemical simulation and provides the framework defining the potential energy surfaces that are used for much of our pictorial understanding of chemical phenomena.
B. Curchod, T. Martínez
semanticscholar   +1 more source