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Crystallography

Exploration of small molecules as inhibitors of potential BACE1 protein to treat amyloid cerebrovascular disease by employing molecular modeling and simulation approaches

Zhizhong Wang, Zhiyong Li, [ ... ], Juanjuan Feng

The binding modes of brazilin and hematein from Caesalpinia sappan L. to Cutibacterium acnes lipase: Simulation studies

Maneenuch Pengsawang, Borvornwat Toviwek, [ ... ], Prapasiri Pongprayoon

Formulation and evaluation of atorvastatin calcium trihydrate Form I tablets

Karen Andrea Salazar-Barrantes, Ariadna Abdala-Saiz, [ ... ], Andrea Mariela Araya-Sibaja

Magnetic effects of thaumatin crystals; observation of crystal growth by magneto-Archimedes levitation and magnetic orientation

Syou Maki, Masao Fujiwara, [ ... ], Kohji Inaka

Pressure dependence of the structural and optoelectronic properties of Pb-free perovskites LiSnX₃ (X = Br and Cl): A DFT approach

Mohammed Noor S. Rammoo, Hameed T. Abdulla, Bewar M. Ahmad, Nawzad A. Abdulkareem

Understanding the history of the late Roman synagogue at Huqoq in Israel’s Galilee through radiocarbon dating and observations on site formation

Dennis Mizzi, Daniel Schindler, [ ... ], Jodi Magness

Improving paraffin precipitate inhibition using glycine and Palm-based Methyl Ester Sulfonate (MES) eco-friendly inhibitors

Nazliah Binti Surpina, Mysara Eissa Mohyaldinn, Abdullah Abduljabbar, Mohammed Abdalla Ayoub

Engineering dimer mutants of human geranylgeranyl pyrophosphate synthase

Sean J. Ezekiel, Mackenzie Searle, Jaeok Park

Predicting the polyspecificity of aminoacyl-tRNA synthetase for non-canonical amino acids using molecular dynamics simulation and MM/PBSA

Dongheon Lee, Jong-il Choi

Biophysical and biochemical evidence for the role of acetate kinases (AckAs) in an acetogenic pathway in pathogenic spirochetes

Ranjit K. Deka, Shih-Chia Tso, Wei Z. Liu, Chad A. Brautigam

The most uniform distribution of points on the sphere

Luca Maria Del Bono, Flavio Nicoletti, Federico Ricci-Tersenghi

Lutein derived from Xenostegia tridentata exhibits anticancer activities against A549 lung cancer cells via hyaluronidase inhibition

Jaruwan Chatwichien, Natthawat Semakul, [ ... ], Somsak Ruchirawat

Identification of core therapeutic targets for Monkeypox virus and repurposing potential of drugs: A WEB prediction approach

Huaichuan Duan, Quanshan Shi, [ ... ], Hubing Shi

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