This valuable study tests a methodology for the discovery of new honey bee-repellent odorants via machine learning. The conclusions of the study are supported by solid evidence, with predicted ...
Huge repeated explosions were heard at the facility in Gatchina - which makes acetone that can be used ... distinctive sweet smell is a widely used solvent and industrial chemical which can ...
School of Chemical Engineering, Changchun University of Technology, Changchun 130012, Jilin, People’s Republic of China Advanced Institute of Materials Science, Changchun University of Technology, ...
Department of Biomedical Devices and Instrumentation, Laboratory for Biomaterials and Bioengineering, Institute of Integrated Research, Institute of Science Tokyo, 2-3-10 Kanda-Surugadai, Chiyoda-ku, ...
The conformers with a distribution higher than 1% will be further optimized. The optimization and frequency of conformers were calculated on B3LYP/6-31G(d) level of theory with the IEF-PCM solvent ...