Computational attributes of protein kinase-C gamma C2-domain & virtual screening for small molecules: elucidation from meta-dynamics simulations & free-energy calculations-Reference-Cited by-同舟云学术

Computational attributes of protein kinase-C gamma C2-domain & virtual screening for small molecules: elucidation from meta-dynamics simulations & free-energy calculations

Published:2022-05-23 Issue: Volume: Page:1-12
ISSN:0739-1102
Container-title:Journal of Biomolecular Structure and Dynamics
language:en
Short-container-title:Journal of Biomolecular Structure and Dynamics

Author:

Singh Harvinder¹,Raja Anupam¹,Shekhar Nishant²^ORCID,Chauhan Arushi³^ORCID,Prakash Ajay²^ORCID,Avti Pramod³^ORCID,Medhi Bikash¹^ORCID

Affiliation:

1. Department of Pharmacology, Postgraduate Institute of Medical Education and Research, Chandigarh, India

2. Department of Medical Microbiology, Postgraduate Institute of Medical Education and Research, Chandigarh, India

3. Department of Biophysics, Postgraduate Institute of Medical Education and Research, Chandigarh, India

Funder

Indian Council of Medical Research

Publisher

Informa UK Limited

Subject

Molecular Biology,General Medicine,Structural Biology

Link

https://www.tandfonline.com/doi/pdf/10.1080/07391102.2022.2077447

Reference44 articles.

1. Abeliovich, A., Kim, J. J., Wehner Jm. & Tonegawa, S. PKCy mutant mice exhibit mild deficits in spatial and contextual learning. 9

2. PKCγ interneurons, a gateway to pathological pain in the dorsal horn

3. Visual Cycle Modulation as an Approach toward Preservation of Retinal Integrity

4. Beldhuis, H. J., De Ruiter, A. J., Maes, F. W., Suzuki, T. & Bohus, B. (1993). Long-term increase in protein kinase C-γ and muscarinic acetylcholine receptor expression in the cerebral cortex of amygdala-kindled rats—a quantitative immunocytochemical study. Neuroscience, 55(4), 965–973.

5. Benfenati, E., Manganaro, A. & Gini, G. C. (2013). VEGA-QSAR: AI inside a platform for predictive toxicology. InPAI@ AI* IA (pp. 21–28).

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