A quinquennial review on recent advancements and developments in search of anti-malarial agents

TM Dhameliya, D Kathuria, TM Patel… - Current Topics in …, 2023 - benthamdirect.com
Malaria has been a major parasitic disease in tropical and subtropical regions and is
estimated to kill between one and two million people (mainly children) every year. Novel anti …

Sustainable approaches towards the synthesis of quinoxalines: An update

A Kumar, TM Dhameliya, K Sharma, KA Patel… - Journal of Molecular …, 2022 - Elsevier
Heterocycles and their derivatives have been inspiring medicinal chemists to device novel,
greener and efficient ways to synthesized them as the majority of drugs available in the …

[HTML][HTML] Integrated network pharmacology and in-silico approaches to decipher the pharmacological mechanism of Selaginella tamariscina in the treatment of non …

S Kumar, F Abbas, I Ali, MK Gupta, S Kumar, M Garg… - Phytomedicine …, 2023 - Elsevier
Background and purpose Non-small cell lung cancer (NSCLC) is a major pathological type
of lung cancer and accounts for more than 80% of all cases. In healthcare management, it is …

Probing the molecular mechanisms of α-synuclein inhibitors unveils promising natural candidates through machine-learning QSAR, pharmacophore modeling, and …

Y Boulaamane, K Jangid, MR Britel, A Maurady - Molecular Diversity, 2024 - Springer
Parkinson's disease is characterized by a multifactorial nature that is linked to different
pathways. Among them, the abnormal deposition and accumulation of α-synuclein fibrils is …

In silico screening, ADMET analysis and MD simulations of phytochemicals of Onosma bracteata Wall. as SARS CoV-2 inhibitors

UG Vegad, ND Gajjar, PR Nagar, SP Chauhan… - 3 Biotech, 2023 - Springer
Being attracted with their cardiotonic, antidiabetic, cough relieving activity, treatment of fever,
absorbent, anti-asthmatic, etc. activities reported in ancient Ayurvedic literature …

In silico identification of five binding sites on the SARS-CoV-2 spike protein and selection of seven ligands for such sites

DF de Oliveira - Journal of Biomolecular Structure and Dynamics, 2024 - Taylor & Francis
To contribute to the development of products capable of complexing with the SARS-CoV-2
spike protein, and thus preventing the virus from entering the host cell, this work aimed at …

Determinants for Sugar-Induced modulation of thermodynamic stability of lysozyme

S Kumar, K Kaur, S Kadhirvel, R Kumar - Journal of Molecular Liquids, 2024 - Elsevier
The current study focuses on the experimental evidence to describe the molecular
mechanism by which the sugars modulate the thermodynamic stability of hen egg-white …

Structure based drug designing approaches in SARS-CoV-2 spike inhibitor design

A Shanmugam, A Venkattappan… - Current Topics in …, 2022 - ingentaconnect.com
The COVID-19 outbreak and the pandemic situation have hastened the research community
to design a novel drug and vaccine against its causative organism, the SARS-CoV-2. The …

[HTML][HTML] Insights into the Gene Expression Profile of Classical Hodgkin Lymphoma: A Study towards Discovery of Novel Therapeutic Targets

AA Aloliqi - Molecules, 2024 - mdpi.com
Classical Hodgkin lymphoma (cHL) is a common B-cell cancer and a significant health
concern, especially in Western and Asian countries. Despite the effectiveness of …

The Malaria Box molecules: a source for targeting the RBD and NTD cryptic pocket of the spike glycoprotein in SARS-CoV-2

K Otazu, GE Olivos-Ramirez… - Journal of Molecular …, 2024 - Springer
Abstract Context SARS-CoV-2, responsible for COVID-19, has led to over 500 million
infections and more than 6 million deaths globally. There have been limited effective …