|
|
|
|
|
Yu Wang, Baozhu Dong, Dong Wang, Xinyu Jia, Qian Zhang, Wanyou Liu and Hongyou Zhou
(-)-Spirobrassinin, a glucosinolate compound from Brassicaceae plants, has shown inhibitory effects on weeds. However, its specific target sites are not well explored. This study used molecular docking, molecular dynamics simulations, and biological expe...
ver más
|
|
|
|
|
|
|
|
|
|
|
Bin Ma, Yunfan Chu, Xiaolin Huang and Bai Yang
The performance indicators of concrete are mainly determined by the interface characteristics between cement hydration slurry and aggregates. In this study, molecular dynamics technology was used to evaluate the effect of the interfacial water content on...
ver más
|
|
|
|
|
|
|
|
|
|
|
Ahyssa R. Cruz and Walter C. Ermler
A code MolecGeom, based on algorithms for stepwise distortions of bond lengths, bond angles and dihedral angles of polyatomic molecules, is presented. Potential energy surfaces (PESs) are curated in terms of the energy for each molecular geometry. PESs b...
ver más
|
|
|
|
|
|
|
|
|
|
|
Laura Orellana
At the very deepest molecular level, the mechanisms of life depend on the operation of proteins, the so-called ?workhorses? of the cell. Proteins are nanoscale machines that transform energy into useful cellular work, such as ion or nutrient transport, i...
ver más
|
|
|
|
|
|
|
|
|
|
|
William Margerit, Antoine Charpentier, Cathy Maugis-Rabusseau, Johann Christian Schön, Nathalie Tarrat and Juan Cortés
The exploration of the energy landscape of a chemical system is essential for understanding and predicting its observable properties. In most cases, this is a challenging task due to the high complexity of such landscapes, which often consist of multiple...
ver más
|
|
|
|
|
|
|
|
|
|
|
Yun Ha Song, Hee Chul Woo and Jaekyoung Lee
Marine biomass has attracted attention as an environmentally sustainable energy source that can replace petroleum-based resources. Alginates, the main natural polysaccharides extracted from seaweeds, are used in various fields, such as food, pharmaceutic...
ver más
|
|
|
|
|
|
|
|
|
|
|
Neeraj Tomar, Geeta Rani, Vijaypal Singh Dhaka, Praveen K. Surolia, Kalpit Gupta, Eugenio Vocaturo and Ester Zumpano
The exponentially growing energy requirements and, in turn, extensive depletion of non-restorable sources of energy are a major cause of concern. Restorable energy sources such as solar cells can be used as an alternative. However, their low efficiency i...
ver más
|
|
|
|
|
|
|
|
|
|
|
Wolfgang Tillmann, Lukas Wojarski, Christian Hopmann, Patricia Fatherazi and Christian Timmer
This paper investigates if the polar groups induced by a plasma treatment can increase the lap shear strength of laser-joined metal and plastic hybrids. Optimal laser joining parameters for cold-rolled AISI304?polyamide 6.6 and sandblasted AISI304?polypr...
ver más
|
|
|
|
|
|
|
|
|
|
|
Fatemeh Mollaamin and Majid Monajjemi
Carbon dioxide (CO2) adsorption on decorated graphene (GR) sheets with transition metals (TMs) including iron, nickel and zinc was investigated for removing this hazardous gas from the environment. TM-doped GR results in higher activity toward gas detect...
ver más
|
|
|
|
|
|
|
|
|
|
|
Ansgar Gruber and Linda K. Medlin
Photosynthesis allows for the formation of biomass from inorganic carbon and therefore greatly enhances the amount of organic material on planet Earth. Especially, oxygenic photosynthesis removed a major bottleneck in the formation of biomass by utilisin...
ver más
|
|
|
|
|
|