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Physical chemistry

Identifying potential inhibitors for wild-type EGFR tyrosine kinase through a cross-talk pathway strategy and an in-silico drug repurposing method

Dorra Abdelmalek, Kawther Bedchich, [ ... ], Mohamed Sami Aifa

Molecular modeling of highly selective CDK1 Inhibitors based on pyrazolo-pyrimidines using 3D-QSAR, docking, and molecular dynamics simulations

Muhammad Afaq Tahir, Tahir Ali Chohan, [ ... ], Khuram Ashfaq

Analysis of molecular targets and mechanisms of Bisphenol F (BPF)-induced non-alcoholic fatty liver disease (NAFLD) based on network toxicology and molecular dynamics

Riwei Wang, Qiangming Liao, [ ... ], Yun Xia

Depositional architecture and post-depositional alteration of the Toutunhe Formation (J₂t) in the Louzhuangzi area, Southern Junggar Basin: Implications for uranium mineralization

Qing Wang, Fengjun Nie, [ ... ], Dong-guang Yang

Multi-scale resistivity imaging for soil moisture and structure characterization in precision agriculture

Widodo, Abdul Salam, Fatkhan, Tedy Setiawan

Rheological characteristics and modification mechanism of rock asphalt compound modified binder based on grey relational analysis

Jinghui Hou, Xiaogang Guo

16S rRNA-based metagenomics insights into the microbial diversity and functional attributes of soils from the rhizosphere of selected C4 crops of farms in Mpumalanga and Limpopo provinces, South Africa

Mamonokane Olga Diale-Makhongela, Tiisetso Mpai, [ ... ], Ahmed Idris Hassen

Comparing the uplink performance of 3D and 2D antenna models in THz networks in the presence of joint human and wall blockages

Tahniyat Aslam, Irfan Ahmed, Sundus Ali

Conceptual thermal constraints on the growth of the first tree on a terraformed Mars

Agnieszka Wendland, Piotr Pałka, [ ... ], Christopher P. McKay

Structure-based pharmacophore modeling, high-throughput screening, and molecular dynamics identify a novel DrugBank-derived HIV-1 protease inhibitor

Ali Sultan Khazaal Nazal, Amjed Majid Rashid Alrashedi, Lamia Abdultef Risan Al-Iessa, Mustafa Abdulkadhim Hussein Ali Rabeea

Understanding mechanistic responses underlying diurnal photoprotection and photosynthetic plasticity among cacao genotypes under natural amazonian field conditions

Juan Carlos Suárez, José Iván Vanegas, Fabricio Eulalio Leite Carvalho

ZIF-8-coated 3D-printed PCL/ion-doped BCP scaffolds for enhanced bone regeneration

Vahid Khademi Ardakani, Niloufar Boroumand, [ ... ], Maryam Abdollahi Asl

Surface modification of carbon-based adsorbents derived from coal gasification slag for the efficient adsorption of trimethoprim

Zhiqiang Yang, Jia Liu, Qingchao Li

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