Drug metabolism: A fascinating link between chemistry and biology N Taxak, PV Bharatam Resonance 19, 259-282, 2014 | 59 | 2014 |
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 | 51 | 2013 |
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 | 50 | 2014 |
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 | 46 | 2012 |
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 | 43 | 2015 |
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 | 40 | 2012 |
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 | 36 | 2014 |
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 | 34 | 2013 |
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 | 30 | 2012 |
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 | 29 | 2011 |
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 | 27 | 2013 |
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 | 14 | 2015 |
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 | 14 | 2010 |
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 | 8 | 2013 |
Synthesis of self-assembling glycerotriazolophanes M Tyagi, N Taxak, PV Bharatam, KPR Kartha RSC advances 2 (30), 11366-11371, 2012 | 7 | 2012 |
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 | | |