Experimental investigation on nano refrigeration using TiO2 CuO and Al2O3 as refrigerants

K Mallikarjuna , K HemachnadraReddy , M NagaRaju
Materials Today: Proceedings

4
2023
Novel third-generation water-soluble noscapine analogs as superior microtubule-interfering agents with enhanced antiproliferative activity

Maged Henary , Lakshminarayana Narayana , Shazia Ahad , Sushma R. Gundala
Biochemical Pharmacology 92 ( 2) 192 -205

14
2014
Elucidating the role of surface passivating ligand structural parameters in hole wave function delocalization in semiconductor cluster molecules

Meghan B. Teunis , Mulpuri Nagaraju , Poulami Dutta , Jingzhi Pu
Nanoscale 9 ( 37) 14127 -14138

6
2017
Mapping Free Energy Pathways for ATP Hydrolysis in the E. coli ABC Transporter HlyB by the String Method

Yan Zhou , Pedro Ojeda-May , Mulpuri Nagaraju , Bryant Kim
Molecules 23 ( 10) 2652

1
2018
Design, synthesis and biological evaluation of di-substituted noscapine analogs as potent and microtubule-targeted anticancer agents

Ram C. Mishra , Sushma R. Gundala , Prasanthi Karna , Manu Lopus
Bioorganic & Medicinal Chemistry Letters 25 ( 10) 2133 -2140

9
2015
Dual Role of Electron-Accepting Metal-Carboxylate Ligands: Reversible Expansion of Exciton Delocalization and Passivation of Nonradiative Trap-States in Molecule-like CdSe Nanocrystals

Katie N. Lawrence , Poulami Dutta , Mulpuri Nagaraju , Meghan B. Teunis
Journal of the American Chemical Society 138 ( 39) 12813 -12825

14
2016
Cyclodextrin Complexes of Reduced Bromonoscapine in Guar Gum Microspheres Enhance Colonic Drug Delivery

Jitender Madan , Sushma R. Gundala , Bharat Baruah , Mulpuri Nagaraju
Molecular Pharmaceutics 11 ( 12) 4339 -4349

21
2014
Molecular cycloencapsulation augments solubility and improves therapeutic index of brominated noscapine in prostate cancer cells.

Jitender Madan , Bharat Baruah , Mulpuri Nagaraju , Mohamed O. Abdalla
Molecular Pharmaceutics 9 ( 5) 1470 -1480

28
2012
Extracellular Calcium Modulates Actions of Orthosteric and Allosteric Ligands on Metabotropic Glutamate Receptor 1α

Jason Y Jiang , Mulpuri Nagaraju , Rebecca C Meyer , Li Zhang
Journal of Biological Chemistry 289 ( 3) 1649 -1661

20
2014
Reaction Path-Force Matching in Collective Variables: Determining Ab Initio QM/MM Free Energy Profiles by Fitting Mean Force

Bryant Kim , Ryan Snyder , Mulpuri Nagaraju , Yan Zhou
Journal of chemical theory and computation 17 ( 8) 4961 -4980

11
2021
A scoring function for the prediction of protein complex interfaces based on the neighborhood preferences of amino acids

Mulpuri Nagaraju , Haiguang Liu
Acta Crystallographica Section D: Structural Biology 79 ( 1) 31 -39

2023
Reaction path-force matching in collective variables: Determining ab initio QM/MM free energy profiles for solution-phase reactions

Bryant Kim , Mulpuri Nagaraju , Yan Zhou , Pedro Ojeda-May
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 255

2018
Cyclophilin A inhibition: Targeting Transition-State-Bound Enzyme Conformations for Structure-Based Drug Design.

Mulpuri Nagaraju , Lauren C McGowan , Donald Hamelberg
J. Chem. Info. Model 53 403 -410

27
2013
5
2016
Active site acidic residues and structural analysis of modelled human aromatase: A potential drug target for breast cancer

J Narashima Murthy , M Nagaraju , G Madhavi Sastry , A Raghuram Rao
Journal of computer-aided molecular design 19 857 -870

21
2005
Comparative study on formamide–water complex

M Nagaraju , G Narahari Sastry
International Journal of Quantum Chemistry 110 ( 10) 1994 -2003

28
2010
11
2007