A combination of structure-based virtual screening and experimental strategies to identify the potency of caffeic acid ester derivatives as SARS-CoV-2 3CLpro inhibitor …
P Pojtanadithee, K Isswanich, K Buaban, S Chamni… - Biophysical …, 2024 - Elsevier
Drug development requires significant time and resources, and computer-aided drug
discovery techniques that integrate chemical and biological spaces offer valuable tools for …
discovery techniques that integrate chemical and biological spaces offer valuable tools for …
[HTML][HTML] Evaluation of the Cytotoxic and Antiviral Effects of Small Molecules Selected by In Silico Studies as Inhibitors of SARS-CoV-2 Cell Entry
F Carvalhal, AC Magalhães, R Rebelo, A Palmeira… - Molecules, 2023 - mdpi.com
The spike protein of the severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2)
relies on host cell surface glycans to facilitate interaction with the angiotensin-converting …
relies on host cell surface glycans to facilitate interaction with the angiotensin-converting …
Polymorphism in 5-methylsalicylic acid: Insights into relative thermal behavior, luminescent properties, crystal structure, and Hirshfeld surface analysis
MY Dong, X Xiong, HY Ji, Y Shi, MQ Lu, MY Ya… - Journal of Molecular …, 2024 - Elsevier
Polymorphs play an important role in mediating the physical and chemical properties of
compounds. Three polymorphs were obtained from different solvents used in crystallization …
compounds. Three polymorphs were obtained from different solvents used in crystallization …