News Articles Tagged: Computational Studies

Computational Insights into 6-Nitroindazole: Structure, Binding, and Activity Prediction

Explore how computational chemistry, including DFT, molecular docking, and MD simulations, aids in understanding the behavior and potential applications of 6-Nitroindazole.

Focus on Alzheimer's: NINGBO INNO PHARMCHEM CO.,LTD.'s Novel 2-Aminopyridine Synthesis and Evaluation

NINGBO INNO PHARMCHEM CO.,LTD. unveils its research on synthesizing novel 2-aminopyridine derivatives, potent cholinesterase inhibitors for Alzheimer's disease, supported by in-depth computational analysis.

3-Aminodibenzofuran in Focus: Computational Studies and Reaction Mechanistic Insights

Delve into the computational approaches and mechanistic investigations used to understand the synthesis and properties of 3-aminodibenzofuran and its derivatives.

Exploring the Computational Insights and Biological Applications of 1,4-Diacetylbenzene Derivatives

Delve into the computational studies and diverse biological activities of 1,4-Diacetylbenzene derivatives, uncovering their potential in drug design and understanding molecular interactions.