The art and science of molecular docking
Molecular docking has become an essential part of a structural biologist's and medicinal
chemist's toolkits. Given a chemical compound and the three-dimensional structure of a …
chemist's toolkits. Given a chemical compound and the three-dimensional structure of a …
Dietary natural products as inhibitors of α-amylase and α-glucosidase: an updated review of ligand-receptor correlations validated by docking studies
M Rangel-Galván, Y Pacheco-Hernández… - Food Bioscience, 2024 - Elsevier
A therapeutic strategy to treat Type 2 diabetes mellitus (T2D) is focused on controlling
postprandial glucose levels by inhibiting α-amylase and α-glucosidase. These enzymes are …
postprandial glucose levels by inhibiting α-amylase and α-glucosidase. These enzymes are …
Chemometrics-based analysis of the phytochemical profile and antioxidant activity of Salvia species from Iran
A Moshari-Nasirkandi, N Iaccarino, F Romano… - Scientific reports, 2024 - nature.com
In recent years, the exploration of the therapeutic potential of Salvia has gained
considerable attention, leading to a growing number of scientific studies emphasizing its …
considerable attention, leading to a growing number of scientific studies emphasizing its …
Phytochemical Profiling, In Vitro Biological Activities, and In-Silico Studies of Ficus vasta Forssk.: An Unexplored Plant
HY Aati, M Anwar, J Al-Qahtani, A Al-Taweel, KR Khan… - Antibiotics, 2022 - mdpi.com
Ficus vasta Forssk.(Moraceae family) is an important medicinal plant that has not been
previously investigated for its phytochemical and biological potential. Phytochemical …
previously investigated for its phytochemical and biological potential. Phytochemical …
[HTML][HTML] Phytochemical, antimicrobial, antidiabetic, thrombolytic, anticancer activities, and in silico studies of Ficus palmata Forssk
J Al-Qahtani, A Abbasi, HY Aati, A Al-Taweel… - Arabian Journal of …, 2023 - Elsevier
Abstract Ficus palmata Forssk.(Moraceae family) is medicinally valuable plant that is mostly
used as folk medicine for the treatment of different diseases. Phytochemical composition …
used as folk medicine for the treatment of different diseases. Phytochemical composition …
Natural products for chronic diseases: A ray of hope
This Special Issue includes many high advanced quality papers that focus on natural
products with their potent pharmacological potential targeting various areas of diseases. The …
products with their potent pharmacological potential targeting various areas of diseases. The …
[HTML][HTML] A detailed biochemical characterization, toxicological assessment and molecular docking studies of Launaea fragilis: An important medicinal xero-halophyte
DA Khan, A Shahid, AE Sherif, HY Aati… - Saudi Pharmaceutical …, 2023 - Elsevier
Abstract Launaea fragilis (Asso) Pau (Family: Asteraceae) is a wild medicinal plant that has
been used in the folklore as a potential treatment for numerous ailments such as skin …
been used in the folklore as a potential treatment for numerous ailments such as skin …
[HTML][HTML] Phytochemical, antioxidant, enzyme inhibitory, thrombolytic, antibacterial, antiviral and in silico studies of Acacia jacquemontii leaves
M Ahmed, S Ahmad, HY Aati, AE Sherif… - Arabian Journal of …, 2022 - Elsevier
The main objective of this work was to gain insight into biological propensities, and bioactive
phytochemicals of Acacia jacquemontii Benth, a wild plant providing medicinal components …
phytochemicals of Acacia jacquemontii Benth, a wild plant providing medicinal components …
Phytochemical characterization of Typha domingensis and the assessment of therapeutic potential using in vitro and in vivo biological activities and in silico studies
R Dilshad, KR Khan, S Ahmad… - Frontiers in …, 2023 - frontiersin.org
Typha domingensis, a medicinal plant with significant traditional importance for curing
various human diseases, has potentially bioactive compounds but was less explored …
various human diseases, has potentially bioactive compounds but was less explored …
Phytochemical Composition, Antibacterial, Antioxidant and Antidiabetic Potentials of Cydonia oblonga Bark
Cydonia oblonga is a medicinal plant that is used to treat a number of health complications
in traditional medication systems. The objective of this study was to evaluate the …
in traditional medication systems. The objective of this study was to evaluate the …