Zobrazeno 1 - 10
of 33
pro vyhledávání: '"Singh, A."'
Publikováno v:
Computational Biology and Chemistry. 78:144-152
We have reported synthesis of a novel 1,2,3-triazole conjugate of lithocholic acid by 1,3-dipolar cycloaddition reaction. The molecular properties such as geometry, conformations, bond lengths and dihedral angles were investigated theoretically. The
Autor:
Sunil K. Gupta, Ramendra K. Singh, Anuradha Singh, Ritika Srivastava, Vishal K. Singh, Farha Naaz, Nidhi Singh, Rajesh Verma
Publikováno v:
Computational Biology and Chemistry. 76:1-16
A series of 2-Cl-benzimidazole derivatives was synthesized and assessed for antibacterial activity. Antibacterial results indicated that compounds 2d, 2e, 3a, 3b, 3c, 4d and 4e showed promising activity against B. cerus, S. aureus and P. aeruginosa (
Autor:
Madhu Yadav, Ritika Srivastava, Farha Naaz, Anuradha Singh, Parth Sarthi Sen Gupta, Ramendra K. Singh, Malay Kumar Rana, Sunil K. Gupta, Satish K. Gupta, Dominique Schols, Vishal K. Singh
Publikováno v:
Computational Biology and Chemistry
Graphical abstract
Highlights • New benzimidazole analogs synthesized as antivirals against HIV-1 and yellow fever virus. • Molecular dynamics simulation studies indicated a stable ligand-protein complex of compound 3a within NNIBP of HIV-RT
Highlights • New benzimidazole analogs synthesized as antivirals against HIV-1 and yellow fever virus. • Molecular dynamics simulation studies indicated a stable ligand-protein complex of compound 3a within NNIBP of HIV-RT
Publikováno v:
Computational Biology and Chemistry. 78:28-36
One specific group of MMPs; gelatinases A (MMP-2) and B (MMP-9) are of precise interest in view of the development and progression of cancer. In the current work, an attempt was made to investigate the enzymatic inhibitory activity of Kutkin (KT), Ku
Publikováno v:
Computational biology and chemistry. 87
We study the origin of TB (tuberculosis) epidemic and complex distributions of various populations of TB infection within the stochastic framework. The stochastic nature of this disease infection could be linked to the stochastic behaviour at genome
Autor:
Sanjay Kumar Singh, M. Sudhakara Reddy
Publikováno v:
Computational biology and chemistry. 92
Drug resistance is increasingly evolving in malaria parasites; hence, it is important to discover and establish alternative drug targets. In this context, GPI-anchor transamidase (GPI-T) is a potential drug target primarily of its crucial role in the
Autor:
Umesh Panwar, Sanjeev Kumar Singh
Publikováno v:
Computational Biology and Chemistry. 93:107509
The rapid increase of HIV-1 infection throughout the globe has a high demand for a superior drug with lesser side effects. LEDGF/p75, the human Lens Epithelium-Derived Growth Factor is identified as a promising cellular cofactor with integrase in fac
Publikováno v:
Computational Biology and Chemistry. 87:107306
High mobility group (HMG) proteins are the major architectural proteins. Among HMG proteins, High Mobility Group A (HMGA) is characterized by AT-hook (ATH) motifs, which have an affinity for AT-rich DNA. In this study, we characterized the plant HMGA
Autor:
Garima Singh, Satarudra Prakash Singh, Monisha Banerjee, Manisha Pritam, Akhilesh Kumar Singh
Publikováno v:
Computational Biology and Chemistry. 86:107259
Visceral leishmaniasis (VL) caused by Leishmania donovani is a fatal parasitic disease affecting primarily the poor population in endemic countries. Increasing number of deaths as well as resistant to existing drugs necessitates the development of an
Publikováno v:
Computational Biology and Chemistry. 83:107104
In this paper, we have established methylenebis (4-hydroxy-2H-chromen-2-one) as a promising anticancer scaffold with kinesin spindle protein (KSP) inhibitory activity under malignant condition. A series of biscoumarin derivatives (MN1 to MN30) with d