Neo-Chlorogenic Acid: Conformational and Molecular Analysis by Semi-Empirical Methods
Posted by
Caio Henrique Alexandre Roberto
on 2019-09-12
This paper shows results regarding semiempiric results for neochlorogenic acid, from geometrical results to molecular descriptors. The gap energy of neochlorogenic acid is considerably higher, having great potential to biochemical applications.
Related content
19 04 2023
< 1 minute
Predicting pKa
One of the most important physicochemical properties of small molecules and macromolecules are the...
12 05 2022
< 1 minute
Coupling stabilizers open KV1-type potassium channels
ABSTRACT: The opening and closing of voltage-gated ion channels are regulated by voltage sensors...
12 11 2021
< 1 minute
Responding to the Challenge Posed by the Generic Control of Substances
Drug monitoring organizations report that new psychoactive substances continue to emerge, posing...
12 10 2021
< 1 minute
Boost analytical experiments with phys-chem properties
Physicochemical properties have a fundamental impact on analytical experiment conditions,...