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1

Ferrocenyl–cymantrenyl hetero-bimetallic chalcones: Synthesis, structure and biological properties

Mishra, Sasmita, Tirkey, Vijaylakshmi, Ghosh, Avishek, Dash, Hirak R., Das, Surajit, Shukla, Madhulata, Saha, Satyen, Mobin, Sheikh M., Chatterjee, Saurav

Journal:

Journal of Molecular Structure

Year:

2015

Language:

english

File:

PDF, 1.19 MB

english, 2015

2

Comparative analysis of machine learning based QSAR models and molecular docking studies to screen potential anti-tubercular inhibitors against InhA of mycobacterium tuberculosis

Kumari, Madhulata, Tiwari, Neeraj, Chandra, Subhash, Subbarao, Naidu

Journal:

International Journal of Computational Biology and Drug Design

Year:

2018

Language:

english

File:

PDF, 3.25 MB

english, 2018

3

Synthesis, structure, UV–Vis–IR spectra, magnetism and theoretical studies on CuII[(2-aminomethyl)pyridine](thiocyanate)2 and comparisons with an analogous CuII complex

Madhulata Shukla, Nitin Srivastava, Satyen Saha, T.R. Rao, Sailaja Sunkari

Journal:

Year:

2011

Language:

english

File:

PDF, 1.43 MB

english, 2011

4

Interaction of collagen with corilagin

Maneesha E. Andrews, Jayaraman Murali, Chellappa Muralidharan, Wuppalamarthy Madhulata, Rajadas Jayakumar

Journal:

Colloid & Polymer Science

Year:

2003

Language:

english

File:

PDF, 242 KB

english, 2003

5

Theoretical and spectroscopic studies of 1-butyl-3-methylimidazolium iodide room temperature ionic liquid: Its differences with chloride and bromide derivatives

Madhulata Shukla, Nitin Srivastava, Satyen Saha

Journal:

Journal of Molecular Structure

Year:

2010

Language:

english

File:

PDF, 927 KB

english, 2010

6

Investigation of ground state charge transfer complex between paracetamol and p-chloranil through DFT and UV–visible studies

Madhulata Shukla, Nitin Srivastava, Satyen Saha

Journal:

Journal of Molecular Structure

Year:

2012

Language:

english

File:

PDF, 649 KB

english, 2012

7

Water square (uudd) in novel CuII framework structures built from isomeric (aminomethyl)pyridines and oxalate: Synthesis, structure, spectral and DFT studies

Shukla, Madhulata, Kharediya, Bhagwan, Srivastava, Nitin, Saha, Satyen, Sunkari, Sailaja

Journal:

Year:

2013

Language:

english

File:

PDF, 975 KB

english, 2013

8

Relationship between stabilization energy and thermophysical properties of different imidazolium ionic liquids: DFT studies

Shukla, Madhulata, Saha, Satyen

Journal:

Computational and Theoretical Chemistry

Year:

2013

Language:

english

File:

PDF, 1.12 MB

english, 2013

9

Synthesis of mono- and bi-metallic dithiocarboxylate-alkyne complexes from sunlight driven insertion reaction and their antibacterial activity

Patel, Sumanta K., Tirkey, Vijaylakshmi, Mishra, Sasmita, Dash, Hirak R., Das, Surajit, Shukla, Madhulata, Saha, Satyen, Mobin, Shaikh M., Chatterjee, Saurav

Journal:

Journal of Organometallic Chemistry

Year:

2014

Language:

english

File:

PDF, 962 KB

english, 2014

10

Influence of metal to ligand molar ratios on the supramolecular structure formation of Cu(II) with diaminopropane and iodide: Synthesis, structure, spectroscopic and DFT studies

Kharediya, Bhagwan, Shukla, Madhulata, Saha, Satyen, Sunkari, Sailaja

Journal:

Journal of Molecular Structure

Year:

2014

Language:

english

File:

PDF, 2.54 MB

english, 2014

11

Solvent induced geometry transformation of trigonal planar Cu(I) complexes of N-((2/4-methyoxy carbonyl) phenyl)-N′-(ethoxy/methoxy carbonyl) thiocarbamides to square-planar Cu(II) complexes: Synthesis, spectral, single crystal, DFT and in vitro cytotoxic study

Singh, Durga P., Pratap, Seema, Shukla, Madhulata

Journal:

Inorganica Chimica Acta

Year:

2014

Language:

english

File:

PDF, 2.56 MB

english, 2014

12

Importance of weak interactions and conformational equilibrium in N-butyl-N-methylpiperidinium bis(trifluromethanesulfonyl) imide room temperature ionic liquids: Vibrational and theoretical studies

Shukla, Madhulata, Noothalapati, Hemanth, Shigeto, Shinsuke, Saha, Satyen

Journal:

Vibrational Spectroscopy

Year:

2014

Language:

english

File:

PDF, 2.27 MB

english, 2014

13

451: Adrenomedullin2 (ADM2) is expressed in fetal membranes and lower amniotic fluid levels are associated with preeclampsia

Yallampalli, Chandrasekhar, Vidaeff, Alex, Yallampalli, Uma, Ramin, Susan, Fox, Karin, Belfort, Michael, Chauhan, Madhulata

Journal:

American Journal of Obstetrics and Gynecology

Year:

2015

Language:

english

File:

PDF, 118 KB

english, 2015

14

Outcomes of Laser Peripheral Iridotomy in Angle Closure Disease

Rao, Aparna, Rao, Harsha L., Kumar, Adepalli U., Babu, Jonnadula G., Madhulata, U., Arthi, J., Tukaram, Mubhar, Senthil, Sirisha, Garudadri, Chandra S.

Journal:

Seminars in Ophthalmology

Year:

2013

Language:

english

File:

PDF, 603 KB

english, 2013

15

Raman spectroscopic study of water tetramer in Cu(3-aminomethyl)pyridine OH2oxalate·2H2O]n

Shukla, Madhulata

Journal:

Year:

2015

Language:

english

File:

PDF, 1.24 MB

english, 2015

16

In silico prediction of anti-malarial hit molecules based on machine learning methods

Kumari, Madhulata, Chandra, Subhash

Journal:

International Journal of Computational Biology and Drug Design

Year:

2015

Language:

english

File:

PDF, 654 KB

english, 2015

17

Does this Young Man with Syncope Deserve Permanent Pacemaker?

Singh, Sukhvinder, Fotedar, Madhulata

Journal:

Visual Journal of Emergency Medicine

Year:

2016

Language:

english

File:

PDF, 1.96 MB

english, 2016

18

Hydrogen bonding interactions in nicotinamide Ionic Liquids: A comparative spectroscopic and DFT studies

Shukla, Madhulata

Journal:

Journal of Molecular Structure

Year:

2017

Language:

english

File:

PDF, 1.03 MB

english, 2017

19

3D QSAR, pharmacophore and molecular docking studies of known inhibitors and designing of novel inhibitors for M18 aspartyl aminopeptidase ofPlasmodium falciparum

Kumari, Madhulata, Chandra, Subhash, Tiwari, Neeraj, Subbarao, Naidu

Journal:

BMC Structural Biology

Year:

2016

Language:

english

File:

PDF, 2.10 MB

english, 2016

20

An Unusual Case of Cholecystitis

Reddy, Madhulata, Reddy, Pavan V.

Journal:

The American Journal of the Medical Sciences

Year:

2003

Language:

english

File:

PDF, 356 KB

english, 2003

21

Catalytic activation of nitrobenzene on PVP passivated silver cluster: A DFT investigation

Shukla, Madhulata, Sinha, Indrajit

Journal:

International Journal of Quantum Chemistry

Year:

2017

Language:

english

File:

PDF, 827 KB

english, 2017

22

Syntheses and characterization of mononuclear Zn(II), Cd(II) and Hg(II) complexes of 2-[(3, 5-Dibromo-2-hydroxy-benzylidene)-amino]-2-hydroxymethyl-propane-1,3-diol: Photoluminescence properties and DFT study

Chatterjee, Sourav, Majumder, Ishani, Chakraborty, Aratrika, Shukla, Madhulata, Chattopadhyay, Tanmay

Journal:

Inorganica Chimica Acta

Year:

2017

Language:

english

File:

PDF, 1.29 MB

english, 2017

23

Adsorption mechanism of phenol, p-chlorophenol, and p-nitrophenol on magnetite surface: A molecular dynamics study

Kuntail, Jyoti, Jain, Yash Manoj, Shukla, Madhulata, Sinha, Indrajit

Journal:

Journal of Molecular Liquids

Year:

2019

Language:

english

File:

PDF, 1008 KB

english, 2019

24

Nanocatalysts || Recent Development of Graphitic Carbon Nitride-Based Photocatalyst for Environmental Pollution Remediation

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 916 KB

english, 2019

25

Nanocatalysts || Transition Metal Chalcogenide (TMC) Nanocomposites for Environmental Remediation Application over Extended Solar Irradiation

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 6.05 MB

english, 2019

26

Nanocatalysts || Platinum Group Metal Based Nanocatalysts for Environmental Decontamination

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 1.61 MB

english, 2019

27

Nanocatalysts || Introductory Chapter: Salient Features of Nanocatalysis

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 703 KB

english, 2019

28

Nanocatalysts || Platinum Group Metal Based Nanocatalysts for Environmental Decontamination

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

File:

PDF, 1.61 MB

2019

29

Nanocatalysts || Iron Oxide Nanoparticles: An Inorganic Phosphatase

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 2.31 MB

english, 2019

30

A genetic programming-based approach to identify potential inhibitors of serine protease of Mycobacterium tuberculosis

Kumari, Madhulata, Tiwari, Neeraj, Subbarao, Naidu

Journal:

Future Medicinal Chemistry

Year:

2019

Language:

english

File:

PDF, 1.01 MB

english, 2019

31

Virtual screening to identify novel potential inhibitors for Glutamine synthetase of Mycobacterium tuberculosis

Kumari, Madhulata, Subbarao, Naidu

Journal:

Journal of Biomolecular Structure and Dynamics

Year:

2019

Language:

english

File:

PDF, 2.20 MB

english, 2019

32

Nanocatalysts || Platinum-Based Carbon Nanodots Nanocatalysts for Direct Alcohol Fuel Cells

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

Language:

english

File:

PDF, 2.53 MB

english, 2019

33

Virtual screening to identify novel potential inhibitors for Glutamine synthetase of Mycobacterium tuberculosis

Kumari, Madhulata, Subbarao, Naidu

Journal:

Journal of Biomolecular Structure and Dynamics

Year:

2019

File:

PDF, 2.20 MB

2019

34

Nanocatalysts || Platinum-Based Carbon Nanodots Nanocatalysts for Direct Alcohol Fuel Cells

Sinha, Indrajit, Shukla, Madhulata

Year:

2019

File:

PDF, 2.53 MB

2019

35

Cardiac Rehabilitation Improves Fitness In Patients With Subclinical Markers Of Cardiotoxicity While Receiving Chemotherapy

Kerrigan, Dennis J., Reddy, Madhulata, Walker, Eleanor, Cook, Bernard, Loutfi, Randa, McCord, James, Baxter, Jodi, Keteyian, Steven J.

Journal:

Medicine & Science in Sports & Exercise

Year:

2019

File:

PDF, 295 KB

2019

36

Ag–Cu Bimetallic Nanoparticles as Efficient Oxygen Reduction Reaction Electrocatalysts in Alkaline Media

Verma, Alkadevi, Gupta, Rajeev Kumar, Shukla, Madhulata, Malviya, Manisha, Sinha, Indrajit

Journal:

Journal of Nanoscience and Nanotechnology

Year:

2020

File:

PDF, 7.57 MB

2020

37

Experimentally formulated and theoretically rationalized alumina immobilized copper catalyst for alcohol oxidation

Chowdhury, Tania, Chatterjee, Sourav, Banerjee, Priyabrata, Sukul, Dipankar, Shukla, Madhulata, Chattopadhyay, Tanmay

Journal:

Journal of Coordination Chemistry

Year:

2020

File:

PDF, 2.97 MB

2020

38

Mechanism of visible light enhanced catalysis over curcumin functionalized Ag nanocatalysts

Verma, Alkadevi, Shukla, Madhulata, Kumar, Sunil, Pal, Shaili, Sinha, Indrajit

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2020

File:

PDF, 1.90 MB

2020

39

Evaluation of predictive models based on random forest, decision tree and support vector machine classifiers and virtual screening of anti-mycobacterial compounds

Kumari, Madhulata, Tiwari, Neeraj, Subbarao, Naidu, Chandra, Subhash

Journal:

International Journal of Computational Biology and Drug Design

Year:

2017

File:

PDF, 2.07 MB

2017

40

In silico prediction and evaluation of interaction between protein arginine N-methyltransferase 5 cancer target and curcumin derivatives by molecular docking and simulation

Kumari, Madhulata, Chandra, Subhash

Journal:

International Journal of Computational Biology and Drug Design

Year:

2017

File:

PDF, 840 KB

2017

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