National Institute of Technology Rourkela

राष्ट्रीय प्रौद्योगिकी संस्थान राउरकेला

ଜାତୀୟ ପ୍ରଯୁକ୍ତି ପ୍ରତିଷ୍ଠାନ ରାଉରକେଲା

An Institute of National Importance

All Publications

Shashi Kumar

Assistant Professor Grade-II
kumars@nitrkl.ac.in

S. Kumar, S. Biswas, and P. A. Despande,"Computational analysis of the effect of Gly100Ala mutation on the thermostability of SazCA", Journal of Biomolecular Structure and Dynamics, vol.41, no.21, pp.12363-12371, Taylor and Francis 2023, 10.1080/07391102.2023.2175259       Article
S. Kumar and P. A. Deshpande,"Efficient proton shuttle makes SazCA an excellent CO2 hydration enzyme", Journal of Biomolecular Structure and Dynamics, vol.41, no.13, pp.6001-6010, Taylor and Francis 2023, 10.1080/07391102.2022.2100828       Article
S. Kumar, V. K. Duggineni, V. Singhania, S. P. Mishra, and P. A. Deshpande,"Unravelling and quantifying the biophysical– biochemical descriptors governing protein thermostability by machine learning", Advanced Theory and Simulations, vol.6, no.3, pp.2200703, Wiley 2023, 10.1002/adts.202200703       Article
S. Kumar, N., K., M. Padole, and P. Deshpande,"Enzyme–substrate interactions in orotate-mimetic OPRT inhibitor complexes: a QM/MM analysis", Physical Chemistry Chemical Physics, vol.25, no.4, pp.3472-3484, Royal Society Of Chemistry 2023, 10.1039/d2cp05406j       Article
S. Kumar and P. Deshpande,"Structural and thermodynamic analysis of factors governing the stability and thermal folding/unfolding of SazCA", PLOS One, vol.16, no.4, pp.e0249866, PLOS 2021, 10.1371/journal.pone.0249866       Article
S. Kumar, D. Seth, and P. A. Deshpande,"Molecular dynamics simulations identify the regions of compromised thermostability in SazCA", Proteins: Structure, Function, and Bioinformatics, vol.89, no.4, pp.375-388, Wiley 2021, 10.1002/prot.26022       Article
M. Verma, V., S. Kumar, and P. Deshpande,"Biomimetic CO2 hydration activity of boronic acids", physical chemistry chemical physics, vol.23, no.15, pp.9561-9570, Royal Society Of Chemistry 2021, 10.1039/D0CP06700H       Article
T. Saha, S. Kumar, and S. K. Bhaumik,"Slip-enhanced flow through thin packed column with superhydrophobic wall", Sensors and Actuators B: Chemical, vol.240, pp.468-476, Elsevier 2017, 10.1016/j.snb.2016.09.012       Article
T. Saha, S. Kumar, and S. K. Bhaumik,"Minimizing axial dispersion in narrow packed column using superhydrophobic wall", Korean Journal of Chemical Engineering, vol.33, pp.3337-3342, Springer Nature 2016, 10.1007/s11814-016-0286-0       Article
R. Singh, A. Prakash, S. Kumar, B. Balagurumurthy, A. K. Arora, S. K. Puri, and T. Bhaskar,"Hydrothermal conversion of lignin to substituted phenols and aromatic ethers", Bioresource Technology, vol.165, pp.319-322, Elsevier 2014, 10.1016/j.biortech.2014.02.076       Article