A review on computer‐aided chemogenomics and drug repositioning for rational COVID‐19 drug discovery
S Maghsoudi, B Taghavi Shahraki… - Chemical Biology & …, 2022 - Wiley Online Library
Application of materials capable of energy harvesting to increase the efficiency and
environmental adaptability is sometimes reflected in the ability of discovery of some traces in …
environmental adaptability is sometimes reflected in the ability of discovery of some traces in …
[HTML][HTML] An understanding of coronavirus and exploring the molecular dynamics simulations to find promising candidates against the Mpro of nCoV to combat the …
The first infection case of new coronavirus was reported at the end of 2019 and after then,
the cases are reported in all nations across the world in a very short period. Further, the …
the cases are reported in all nations across the world in a very short period. Further, the …
[HTML][HTML] Repurposing of phytomedicine-derived bioactive compounds with promising anti-SARS-CoV-2 potential: Molecular docking, MD simulation and drug-likeness …
In view of the potential of traditional plant-based remedies (or phytomedicines) in the
management of COVID-19, the present investigation was aimed at finding novel anti-SARS …
management of COVID-19, the present investigation was aimed at finding novel anti-SARS …
In silico screening of phytopolyphenolics for the identification of bioactive compounds as novel protease inhibitors effective against SARS-CoV-2
M Rudrapal, AR Issahaku, C Agoni… - Journal of …, 2022 - Taylor & Francis
Due to the unavailability specific drugs or vaccines (FDA approved) that can cure COVID-19,
the development of potent antiviral drug candidates/therapeutic molecules against COVID …
the development of potent antiviral drug candidates/therapeutic molecules against COVID …
Valorization of Kappaphycus alvarezii through extraction of high-value compounds employing green approaches and assessment of the therapeutic potential of κ …
This study utilizes different emerging green extraction technologies to recover maximum
value-added products from Kappaphycus alvarezii and evaluate their bio-functional …
value-added products from Kappaphycus alvarezii and evaluate their bio-functional …
Molecular docking and dynamic simulations of Cefixime, Etoposide and Nebrodenside A against the pathogenic proteins of SARS-CoV-2
H ur Rashid, N Ahmad, M Abdalla, K Khan… - Journal of molecular …, 2022 - Elsevier
The catastrophe of the coronavirus continues from one part of the world to another, and
hardly a country is left without its devastations. Millions of people were infected and several …
hardly a country is left without its devastations. Millions of people were infected and several …
[HTML][HTML] Carbon fullerene and nanotube are probable binders to multiple targets of SARS-CoV-2: Insights from computational modeling and molecular dynamic …
The present study aimed to predict the binding potential of carbon nanotube and nano
fullerene towards multiple targets of SARS-CoV-2. Based on the virulent functions, the spike …
fullerene towards multiple targets of SARS-CoV-2. Based on the virulent functions, the spike …
AI-Driven Discovery of SARS-CoV-2 Main Protease Fragment-like Inhibitors with Antiviral Activity In Vitro
LC Saramago, MV Santana, BF Gomes… - Journal of Chemical …, 2023 - ACS Publications
SARS-CoV-2 is the causative agent of COVID-19 and is responsible for the current global
pandemic. The viral genome contains 5 major open reading frames of which the largest …
pandemic. The viral genome contains 5 major open reading frames of which the largest …
Novel Drug Design for Treatment of COVID‐19: A Systematic Review of Preclinical Studies
Background. Since the beginning of the novel coronavirus (SARS‐CoV‐2) disease
outbreak, there has been an increasing interest in discovering potential therapeutic agents …
outbreak, there has been an increasing interest in discovering potential therapeutic agents …
Computational drug design of novel COVID-19 inhibitor
Background In 2003, the first case of severe acute respiratory syndrome coronavirus (SARS-
CoV) was recorded. Coronaviruses (CoVs) have caused a major outbreak of human fatal …
CoV) was recorded. Coronaviruses (CoVs) have caused a major outbreak of human fatal …