Topological solitons in chain molecular crystals with stoichiometric obstacles and hydrogen bonds
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Physics and Chemistry of Solids"
DOI: 10.1016/j.jpcs.2020.109514
Abstract: Abstract The present paper examines molecular motion mechanisms in lamellar molecular crystals of undecylenic acid. Thermophysical, dielectric, and infrared spectroscopy methods were used to demonstrate the presence of a relaxation process in crystals of undecylenic… read more here.
Keywords: hydrogen bonds; molecular crystals; solitons chain; chain molecular ... See more keywords
MCDCalc: Markov Chain Molecular Descriptors Calculator for Medicinal Chemistry.
Sign Up to like & getrecommendations! Published in 2019 at "Current topics in medicinal chemistry"
DOI: 10.2174/1568026620666191226092431
Abstract: BACKGROUND Cheminformatics models are able to predict different outputs (activity, property, chemical reactivity) in single molecules or complex molecular systems (catalyzed organic synthesis, metabolic reactions, nanoparticles, etc.). OBJECTIVE Cheminformatics prediction of complex catalytic enantioselective reactions… read more here.
Keywords: markov; medicinal chemistry; chemistry; chain molecular ... See more keywords