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Nikhil Taxak
Nikhil Taxak
National Institute of Pharmaceutical Education and Research
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Drug metabolism: A fascinating link between chemistry and biology
N Taxak, PV Bharatam
Resonance 19, 259-282, 2014
592014
Carbene generation by cytochromes and electronic structure of heme-iron-porphyrin-carbene complex: a quantum chemical study
N Taxak, B Patel, PV Bharatam
Inorganic chemistry 52 (9), 5097-5109, 2013
512013
In (III) triflate-mediated solvent-free synthesis and activation of thioglycosides by ball milling and structural analysis of long chain alkyl thioglycosides by TEM and quantum …
V Kumar, N Taxak, R Jangir, PV Bharatam, KPR Kartha
The Journal of Organic Chemistry 79 (8), 3427-3439, 2014
502014
C–H Bond Functionalization Under Metalation–Deprotonation Process: Regioselective Direct Arylation of 3-Aminoimidazo[1,2-a]pyrazine
SK Guchhait, S Kandekar, M Kashyap, N Taxak, PV Bharatam
The Journal of Organic Chemistry 77 (18), 8321-8328, 2012
462012
Toxicity originating from thiophene containing drugs: exploring the mechanism using quantum chemical methods
CK Jaladanki, N Taxak, RA Varikoti, PV Bharatam
Chemical research in toxicology 28 (12), 2364-2376, 2015
432015
Metabolic‐intermediate complex formation with cytochrome P450: Theoretical studies in elucidating the reaction pathway for the generation of reactive nitroso intermediate
N Taxak, PV Desai, B Patel, M Mohutsky, VJ Klimkowski, V Gombar, ...
Journal of computational chemistry 33 (21), 1740-1747, 2012
402012
Importance of cytochromes in cyclization reactions: quantum chemical study on a model reaction of proguanil to cycloguanil
M Arfeen, DS Patel, S Abbat, N Taxak, PV Bharatam
Journal of computational chemistry 35 (28), 2047-2055, 2014
362014
Mechanism-based inactivation of cytochromes by furan epoxide: unraveling the molecular mechanism
N Taxak, S Kalra, PV Bharatam
Inorganic Chemistry 52 (23), 13496-13508, 2013
342013
Density Functional Study on the Cytochrome-Mediated S-Oxidation: Identification of Crucial Reactive Intermediate on the Metabolic Path of Thiazolidinediones
N Taxak, VA Dixit, PV Bharatam
The Journal of Physical Chemistry A 116 (42), 10441-10450, 2012
302012
S-oxidation of thiazolidinedione with hydrogen peroxide, peroxynitrous acid, and C4a-hydroperoxyflavin: a theoretical study
N Taxak, V Parmar, DS Patel, A Kotasthane, PV Bharatam
The Journal of Physical Chemistry A 115 (5), 891-898, 2011
292011
Mechanistic insights into the bioactivation of phenacetin to reactive metabolites: A DFT study
N Taxak, KC Prasad, PV Bharatam
Computational and Theoretical Chemistry 1007, 48-56, 2013
272013
Mechanochemical click reaction as a tool for making carbohydrate-based triazole-linked self-assembling materials (CTSAMs)
M Tyagi, N Taxak, PV Bharatam, H Nandanwar, KPR Kartha
Carbohydrate research 407, 137-147, 2015
142015
An Insight into the Concept and Details of Mechanism-Based Inhibition of CYP450
N Taxak, PV Bharatam
Current Research in Pharmaceutical Sciences (CRIPS) 11, 62-67, 2010
142010
2D QSAR Study for Gemfibrozil Glucuronide as the Mechanism-based Inhibitor of CYP2C8
N Taxak, PV Bharatam
Indian Journal of Pharmaceutical Sciences 75 (6), 680, 2013
82013
Synthesis of self-assembling glycerotriazolophanes
M Tyagi, N Taxak, PV Bharatam, KPR Kartha
RSC advances 2 (30), 11366-11371, 2012
72012
CâÄìH Bond Functionalization Under MetalationâÄìDeprotonation Process: Regioselective Direct Arylation of 3-Aminoimidazo [1, 2-a] pyrazine
SK Guchhait, S Kandekar, M Kashyap, N Taxak, PV Bharatam
Journal of organic chemistry, 2012
2012
In (III) Triflate-Mediated Solvent-Free Synthesis of Thioglycosides by Ball Milling
S Maurya, V Kumar, N Taxak, PV Bharatam, KPR Kartha
Quantum Chemical Studies on Drug Metabolism and Toxicity
N TAXAK, VA DIXIT, PV BHARATAM
Theoretical and Computational Advances: From Atoms to Molecules to Materials …, 0
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