Lesson from ecotoxicity: revisiting the microbial lipopeptides for the management of emerging diseases for crop protection

D Malviya, PK Sahu, UB Singh, S Paul, A Gupta… - International journal of …, 2020 - mdpi.com
Microorganisms area treasure in terms of theproduction of various bioactive compounds
which are being explored in different arenas of applied sciences. In agriculture, microbes …

Computational approaches to the rational design of tubulin-targeting agents

H Pérez-Peña, AC Abel, M Shevelev, AE Prota… - Biomolecules, 2023 - mdpi.com
Microtubules are highly dynamic polymers of α, β-tubulin dimers which play an essential role
in numerous cellular processes such as cell proliferation and intracellular transport, making …

Molecular docking and dynamics simulation of protein β-tubulin and antifungal cyclic lipopeptides

NN Cob-Calan, LA Chi-Uluac, F Ortiz-Chi… - Molecules, 2019 - mdpi.com
To elucidate interactions between the antifungal cyclic lipopeptides iturin A, fengycin, and
surfactin produced by Bacillus bacteria and the microtubular protein β-tubulin in plant …

Virtual screening of natural products database

JA de Sousa Luis, RPC Barros… - Mini Reviews in …, 2021 - ingentaconnect.com
Constant research on natural products has generated, over time, a large number of
compounds with the potential to be evaluated in several biological tests and subsequently …

[HTML][HTML] Application of ensemble pharmacophore-based virtual screening to the discovery of novel antimitotic tubulin inhibitors

L Gallego-Yerga, R Ochoa, I Lans… - Computational and …, 2021 - Elsevier
Tubulin is a well-validated target for herbicides, fungicides, anti-parasitic, and anti-tumor
drugs. Many of the non-cancer tubulin drugs bind to its colchicine site but no colchicine-site …

Comparative analysis of the interaction of mono-, dis-, and tris-azo food dyes with egg white lysozyme: A combined spectroscopic and computational simulation …

D Wu, R Duan, F Geng, X Hu, N Gan, H Li - Food chemistry, 2019 - Elsevier
Egg white lysozyme plays an important role in the processing of high value-added poultry
products. Considering its applications in the food industry, lysozyme could interact with other …

Xanthatin and 8-epi-xanthatin as new potential colchicine binding site inhibitors: a computational study

D Alpízar-Pedraza, AN Veulens, YMÁ Ginarte… - Journal of Molecular …, 2023 - Springer
Context Phytocompounds xanthatin and 8-epi-xanthatin, obtained from Xanthium chinese
Mill, showed antitumoral activity in vitro related to the microtubules destabilizing properties …

[HTML][HTML] Targeting the Cyclin-Dependent Kinase Family in Anticancer Drug Discovery: From Computational to Experimental Studies

P Solanki, S Sarwadia, M Athar, PC Jha… - Chemical Physics …, 2024 - Elsevier
Uncontrolled cell proliferation, primarily regulated by cyclin-dependent kinases (CDKs), is a
critical driver of cancer progression, with dysregulation of CDKs contributing to various …

[PDF][PDF] Xantatina y 8-epi-xantatina como inhibidores de la quinesina Eg5. Un análisis computacional

EC Araújo - fototeca.uh.cu
El cáncer comprende un grupo de enfermedades con características similiares. Uno de los
rasgos más importantes de este tipo de dolencias es la desregulación de los procesos que …

[PDF][PDF] Xantanólidos (xantatina y 8-epi-xantatina) moléculas con actividad antimitótica: Modelación in silico de su posible mecanismo de interacción con la tubulina.

DA Pedraza, CYMÁ Ginarte - fototeca.uh.cu
Los isómeros xantatina y 8-epi-xanntatina, obtenidos de Xanthium strumarium, poseen
actividad antitumoral in vitro, la cual se ha relacionado con las propiedades …