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Dr. Vaibhav Jain
Dr. Vaibhav Jain
Senior Team Lead, RDIT-Modelling and Simulations, PI Industries, Udaipur India
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Cited by
Cited by
Year
N-Fused imidazoles as novel anticancer agents that inhibit catalytic activity of topoisomerase II and induce apoptosis in G1/S phase
AT Baviskar, C Madaan, R Preet, P Mohapatra, V Jain, A Agarwal, ...
Journal of medicinal chemistry, 2011
3282011
Dendrimer building toolkit: Model building and characterization of various dendrimer architectures
PKM Vishal Maingi, Vaibhav Jain, Prasad V. Bharatam
Journal of Computational Chemistry, 2012
1292012
Molecular dynamics simulations of PPI dendrimer–drug complexes
V Jain, V Maingi, PK Maiti, PV Bharatam
Soft Matter 9 (28), 6482-6496, 2013
622013
5-Fluorouracil mediated anti-cancer activity in colon cancer cells is through the induction of Adenomatous Polyposis Coli: Implication of the long-patch base excision repair …
D Das, R Preet, P Mohapatra, SR Satapathy, S Siddharth, T Tamir, V Jain, ...
DNA repair 24, 15-25, 2014
572014
Pharmacoinformatic approaches to understand complexation of dendrimeric nanoparticles with drugs
V Jain, PV Bharatam
Nanoscale 6 (5), 2476-2501, 2014
562014
Combretastatin A-4 inspired novel 2-aryl-3-arylamino-imidazo-pyridines/pyrazines as tubulin polymerization inhibitors, antimitotic and anticancer agents
N Sanghai, V Jain, R Preet, S Kandekar, S Das, N Trivedi, P Mohapatra, ...
MedChemComm 5 (6), 766-782, 2014
522014
Design and synthesis of novel xanthine derivatives as potent and selective A2B adenosine receptor antagonists for the treatment of chronic inflammatory airway diseases
S Basu, DA Barawkar, V Ramdas, M Patel, Y Waman, A Panmand, ...
European journal of medicinal chemistry 134, 218-229, 2017
402017
Origins of the specificity of inhibitor P218 toward wild-type and mutant PfDHFR: a molecular dynamics analysis
S Abbat, V Jain, PV Bharatam
Journal of Biomolecular Structure and Dynamics 33 (9), 1913-1928, 2015
352015
Identification of Druggable Targets for Acinetobacter baumannii Via Subtractive Genomics and Plausible Inhibitors for MurA and MurB
N Kaur, M Khokhar, V Jain, PV Bharatam, R Sandhir, R Tewari
Applied Biochemistry and Biotechnology, 1-20, 2013
332013
Design, Synthesis of Novel, Potent, Selective, Orally Bioavailable Adenosine A2A Receptor Antagonists and Their Biological Evaluation
S Basu, DA Barawkar, S Thorat, YD Shejul, M Patel, M Naykodi, V Jain, ...
Journal of Medicinal Chemistry 60 (2), 681-694, 2017
272017
Atomic level insights into realistic molecular models of dendrimer-drug complexes through MD simulations
V Jain, PK Maiti, PV Bharatam
The Journal of Chemical Physics 145 (12), 2016
232016
Discovery of liver-directed glucokinase activator having anti-hyperglycemic effect without hypoglycemia
AM Deshpande, D Bhuniya, S De, B Dave, VP Vyavahare, SH Kurhade, ...
European journal of medicinal chemistry 133, 268-286, 2017
212017
Structural Elaboration of a Natural Product: Identification of 3, 3′‐Diindolylmethane Aminophosphonate and Urea Derivatives as Potent Anticancer Agents
S Kandekar, R Preet, M Kashyap, RP MU, P Mohapatra, D Das, ...
ChemMedChem 8 (11), 1873-1884, 2013
192013
Rational design, synthesis, and structure–activity relationships of 5-amino-1H-pyrazole-4-carboxylic acid derivatives as protein tyrosine phosphatase 1B inhibitors
S Basu, P Prathipati, S Thorat, S Ansari, M Patel, V Jain, RR Jinugu, ...
Bioorganic & Medicinal Chemistry 25 (1), 67-74, 2017
182017
Molecular modelling and QSAR analysis of some structurally diverse N-type calcium channel blockers
J Mungalpara, A Pandey, V Jain, CG Mohan
Journal of molecular modeling 16, 629-644, 2010
172010
Synthesis, biological evaluation, and molecular modeling studies of novel heterocyclic compounds as anti-proliferative agents
A Chaudhary, PP Sharma, G Bhardwaj, V Jain, PV Bharatam, ...
Medicinal Chemistry Research, 1-16, 2013
162013
3-Formylchromone Based Topoisomerase IIα Inhibitors: Discovery of Potent Leads
S Singh, AT Baviskar, V Jain, N Mishra, UC Banerjee, PV Bharatam, ...
Med. Chem. Commun., 2013
152013
Uridine monophosphate kinase as potential target for tuberculosis: From target to lead identification
A Arvind, V Jain, P Saravanan, CG Mohan
Interdisciplinary Sciences: Computational Life Sciences 5 (4), 296-311, 2013
122013
Conformational polymorphism in bicalutamide: a quantum chemical study
DK Dhaked, V Jain, Y Kasetti, PV Bharatam
Structural Chemistry, 2012
122012
Computational study on the conformational preferences in nateglinide
V Jain, DK Dhaked, Y Kasetti, PV Bharatam
Journal of Physical Organic Chemistry, 2012
112012
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Articles 1–20