Interaction of norsecurinine-type monomeric and dimeric alkaloids with α-tubulin: a molecular docking study by Gérard Vergoten, Christian Bailly

“…The pironetin-binding site model (5FNV) was selected for the subsequent docking analysis with all compounds. Empirical energies of interaction (ΔE) were measured and compared. …”
Get full text

Investigation of Fe-Doped Graphitic Carbon Nitride-Silver Tungstate as a Ternary Visible Light Active Photocatalyst by Eid H. Alosaimi, Nadia Azeem, Noor Tahir, Asim Jilani, Muhammad Zahid, Salman. S. Alharthi, Javed Iqbal, Muhammad Yaseen, Zulfiqar Ahmad Rehan, Imran Shahid

“…Characterization analysis included SEM analysis, FTIR, XRD, XPS, and UV-Visible techniques to elucidate the morphology and chemical structuring of the as-prepared heterostructure. The bandgap energies were assessed using the Tauc plot. The ternary nanocomposite (Fe-CN-AW) showed increased photodegradation efficiency (97%) within 120 minutes, at optimal conditions of pH = 8, catalyst dose = 50 mg/100 ml, an initial RhB concentration of 10 ppm, and oxidant dose 5 mM under sunlight irradiation. …”
Get full text

Investigation of Scutellaria Barbata’s immunological mechanism against thyroid cancer using network pharmacology and experimental validation by Gen Ouyang, Yuangui Zhu, Zhehao Ouyang

“…Molecular docking demonstrated that SPP1 has high binding stability with quercetin, Rhamnazin, and Salvigenin, with binding energies of -8.117, -7.494, and − 7.202 kJ∙mol − 1, respectively. …”
Get full text

Solution-Based Ultraviolet Photodiode with ZnO Nanoparticle/Poly(3,4-Ethylenedioxythiophene) Polystyrene Sulfonate Heterojunction and Negative Capacitance by Jin Li, Xin Chang, Shunpu Li, Yi Zhang, Daping Chu

Get full text

LAND COVER AND LAND USE CHANGES REFLECTING THE ENVIRONMENTAL IMPACTS OF LOCAL DECLINING ECONOMIES. CASE-STUDY: SOUTH-WEST DEVELOPMENT REGION. ROMANIA by ALEXANDRU-IONUŢ PETRISOR

“…Les changements dans la couverture et l’utilisation du terrain, les modifications des circuits de l’énergie et les changements climatiques sont constituants des «changements globaux», terme incluant tous les impacts humains sous les complexes des systèmes socio-écologiques. …”
Get full text

Diversity and Dynamics of Sand Flies (Diptera: Psychodidae) of Two Cutaneous Leishmaniasis Foci in the Fes-Boulemane Region of Northern Morocco by Fatima Zahra Talbi, Chafika Faraj, Fouad EL-Akhal, Fatiha El Khayyat, Driss Chenfour, Abdellatif Janati Idrissi, Abdelhakim El Ouali Lalami

Get full text

Litho-structural framework of mineralization along the Ait Atmane fault zone (High Atlas, Morocco): Insights from remote sensing and field data by Ijaajaane Abdelhak, Ait Ali Abdelkhiar, Kajji Souhaila, Si Mhamdi Hicham, Baidder Lahssen, Raji Mohammed

Get full text

Dietary Phosphorus Requirement of Giant Gouramy (Osphronemus gouramy Lac.) by M. Agus Suprayudi, Mia Setiawati

“…Pakan yang digunakan dalam penelitian ini adalah pakan semimumi dengan kadar protein 41,0% dan rasio energi- protein 10 kkal/g protein. Pakan yang digunakan memiliki kandungan fosfor berturut-turut sebesar 0,32, 0,63, 0,89 dan 1,06%. …”
Get full text

Pemanfaatan Pelayanan Posyandu sebagai Faktor Risiko Dominan Kejadian Gagal Tumbuh pada Balita di Wilayah Puskesmas Pringsurat by Diah Aprilia Putri, Suyatno Suyatno, Siti Fatimah

“…Hasil: Subjek lebih banyak berjenis kelamin perempuan, berusia 24-59 bulan, dengan berat lahir normal, pernah mengalami infeksi, memanfaatkan pelayanan posyandu dengan baik, memiliki pola asuh yang baik, dengan konsumsi energi yang kurang dan konsumsi protein yang cukup. …”
Get full text

Analysis of Forest Cover in the Tumba-Lediima Nature Reserve (RTL-DRC) by Sylvestre Frey, André Musas A Musas, Nestor Anzola Kibamba, Sebastien Kidushi Mboma, Tege Simboni Simboni, Djonive Munene Asidi

Get full text

Algorithms for Solving the Equilibrium Composition Model of Arc Plasma by Zhongyuan Chi, Yuzhang Ji, Ningning Liu, Tianchi Jiang, Xin Liu, Weijun Zhang

“…This weak singularity primarily arises due to significant discrepancies in the coefficients between the Saha equation and the Guldberg–Waage equation, attributed to differing chemical reaction energies. By contrast, the coefficients in the equations derived from the other three principles within the equilibrium composition model are predominantly single−digit constants, further contributing to the system’s weak singularity. …”
Get full text

Integrating machine learning and structure-based approaches for repurposing potent tyrosine protein kinase Src inhibitors to treat inflammatory disorders by Muhammad Waleed Iqbal, Muhammad Shahab, Zakir ullah, Guojun Zheng, Irfan Anjum, Gamal A. Shazly, Atrsaw Asrat Mengistie, Xinxiao Sun, Qipeng Yuan

“…Molecular Mechanics/Generalized Born Surface Area (MMGBSA) analysis validated their binding affinities by providing comparably lower binding free energies for orlistat (− 33.4743 ± 3.8908), acarbose (− 19.5455 ± 5.4702), and afatinib (− 36.4944 ± 5.4929) than the control, dasatinib (− 13.7785 ± 5.8058). …”
Get full text

Modelling of a new form of nitrogen doped activated carbon for adsorption of various dyes and hexavalent chromium ions by Mohamed A. El-Nemr, Uyiosa Osagie Aigbe, Kingsley Eghonghon Ukhurebor, Kingsley Obodo, Adetunji Ajibola Awe, Mohamed A. Hassaan, Safaa Ragab, Ahmed El Nemr

“…Based on the computational adsorption calculations, the sorption energies for the AO7 and AB14 dyes were -4.492 and -8.090 eV and 2.563, 1.789, 1.226 and 1.928 eV for Cr2, CrO3, CrO4, and CrO4H species. …”
Get full text

The promotion effect of FeS2 on Sb2S3 bioleaching and Sb speciation transformation by Xing-fu Zheng, Xing-fu Zheng, Xing-fu Zheng, Jin-lan Xia, Jin-lan Xia, Zhen-yuan Nie, Zhen-yuan Nie, Hong-peng Cao, Hong-peng Cao, Rui-Jia Hu, Yu-ting Liang, Hong-chang Liu, Hong-chang Liu

“…The DFT results show that between the Sb2S3 (0 1 0) and FeS2 (1 0 0) surfaces, S-Fe, S-S, S-Sb, and Sb-Fe bonds are formed, and the direction of electron transfer is from Sb2S3 to FeS2; the work functions for Sb2S3 after addition of FeS2 decrease, implying that faster electron transfer occurs; Fe(III)-6H2O derived from FeS2 adsorbs on the surface more easily than does glucose, which is the major component of the extracellular polymeric substances in bacteria, indicating that during the bioleaching process, Fe(III)-6H2O plays an important role; after mixing, both Fe(III)-6H2O and glucose adsorb on the Sb2S3 (0 1 0) surface more easily, with stronger bonds and larger adsorption energies, which are in good agreement with the experimental results.…”
Get full text

Computational identification of anti-cancer compounds targeting the RNA-binding domain of human FOX-1 protein (RBFOX1) by Muhammad Tahir ul Qamar, Pablo Sanz-Jimenez, Shaima Rabeea Banoon, Xi-Tong Zhu, Fahad M. Aldakheel, Nahlah Makki Almansour, Leen A. Aldaiji, Wafa Abdullah I. Al-Megrin, Faisal Ahmad

“…All of the top hit inhibitor exhibited more stability in comparison to the control inhibitor, where it penetrated deeply, as depicted in PCA analysis. Binding energies and Waterswap calculations significantly refines our comprehensive simulation model. …”
Get full text

Influence de la perlite sur le comportement mécanique, l’absorption capillaire et la conductivité thermique des mortiers by Omar Belaribi, Omar Safer, Nadia Belas, Khalil Belguesmia, Rachid Hadj Sadok

Get full text

The dynamics of excited state structural relaxation of 4-dimethylaminobenzonitrile (DMABN) and related compounds

“…The rate constants of the twisted state formation have been calculated in the temperature range <mml:math alttext="$293$"> <mml:mn>293</mml:mn> </mml:math>&#8211;<mml:math alttext="$77$"> <mml:mn>77</mml:mn> </mml:math> K. The activation energies of forward process for compounds studied have been estimated.…”
Get full text

Człowiek i przyroda w nauce chrześcijańskiego Wschodu by Janusz Aptacy

“…All of the created universe can participate in divine "energies" only through man, who is "priest and caretaker" of the universe. …”
Get full text

Effects of scrap rubber waste on the mechanical performance of mortar made of crushed sand and sediment by Adda Hadj Mostefa, Benamar Balegh, Hamid Sellaf, Mohamed Elamine Dahamni

Get full text

Assessing greenhouse gas emissions in hospitals: The development of an open-access calculator and its application to a German case-study by Claudia Quitmann, Leonard Terres, Andy Maun, Rainer Sauerborn, Emma Reynolds, Till Bärnighausen, Alina Herrmann, Bernd Franke

Get full text