|A Computational Chemical Insight into Microscopic Additive Effect on Solid Electrolyte Interphase Film Formation in Sodium-Ion Batteries: Suppression of Unstable Film Growth by …|
MN Norio Takenaka , Hirofumi Sakai , Yuichi Suzuki , Purushotham Uppula
J. Phys. Chem. C, 2015
|Novel biosynthesized gold nanoparticles as anti-cancer agents against breast cancer: Synthesis, biological evaluation, molecular modelling studies|
SK Vemuri, RR Banala, S Mukherjee, P Uppula, GPV Subbaiah, GR AV, ...
Materials Science and Engineering: C 99, 417-429, 2019
|Trimethylsumanene: Enantioselective Synthesis, Substituent Effect on Bowl Structure, Inversion Energy, and Electron Conductivity|
S Higashibayashi, R Tsuruoka, Y SOUJANYA, U PURUSHOTHAM, ...
Bulletin of the Chemical Society of Japan 85 (4), 450-467, 2012
|Additive Effect of Fluoroethylene and Difluoroethylene Carbonates for the Solid Electrolyte Interphase Film Formation in Sodium-Ion Batteries: A Quantum Chemical Study|
MN Purushotham Uppula, Norio Takenaka
RSC Advances, 2016
|Synthesis and biological evaluation of Schizandrin derivatives as potential anti-cancer agents|
D Amujuri, B Siva, B Poornima, K Sirisha, AVS Sarma, VL Nayak, ...
European journal of medicinal chemistry 149, 182-192, 2018
|Synthesis, biological evaluation, and molecular modeling of (E)-2-aryl-5-styryl-1,3,4-oxadiazole derivatives as acetylcholine esterase inhibitors|
A Kamal, AB Shaik, GN Reddy, CG Kumar, J Joseph, GB Kumar, ...
Medicinal Chemistry Research 23, 2080-2092, 2014
|Conjugate acene fused buckybowls: evaluating their suitability for p-type, ambipolar and n-type air stable organic semiconductors|
U Purushotham, GN Sastry
Physical Chemistry Chemical Physics 15 (14), 5039-5048, 2013
|A computational investigation and the conformational analysis of dimers, anions, cations, and zwitterions of L‐phenylalanine|
U Purushotham, D Vijay, G Narahari Sastry
Journal of computational chemistry 33 (1), 44-59, 2012
|Synthesis and biological evaluation of bergenin-1, 2, 3-triazole hybrids as novel class of anti-mitotic agents|
PP Kumar, B Siva, BV Rao, GD Kumar, VL Nayak, SN Jain, AK Tiwari, ...
Bioorganic Chemistry 91, 103161, 2019
|A comprehensive conformational analysis of tryptophan, its ionic and dimeric forms|
U Purushotham, GN Sastry
Journal of Computational Chemistry 35 (8), 595-610, 2014
|Exploration of conformations and quantum chemical investigation of l-tyrosine dimers, anions, cations and zwitterions: a DFT study|
U Purushotham, G Narahari Sastry
Theoretical Chemistry Accounts 131, 1-14, 2012
|Metabolite profiling and biological activities of bioactive compounds produced by Chrysosporium lobatum strain BK-3 isolated from Kaziranga National Park, Assam, India|
CG Kumar, P Mongolla, P Sujitha, J Joseph, KS Babu, G Suresh, ...
SpringerPlus 2 (1), 122, 2013
|A first-principles investigation of histidine and its ionic counterparts|
U Purushotham, H Zipse, GN Sastry
Theoretical Chemistry Accounts 135, 1-16, 2016
|Synthesis of novel α-amino acid functionalized 6-fluoro quinolones, their anti-bacterial activity and molecular docking studies|
BP Lingaiah, T Yakaiah, AC Shekhar, AR Kumar, G Sathaiah, K Raju, ...
NISCAIR-CSIR, India, 2012
|Exploration of conformations, analysis of protein and biological significance of histidine dimers|
ChemistrySelect 3 (11), 3070-3078, 2018
|Computational Molecular Technology Toward Macroscopic Chemical Phenomena: Red Moon Methodology and Its Related Applications|
M Nagaoka, M Takayanagi, N Takenaka, Y Suzuki, K Matsumoto, N Koga, ...
Molecular Technology: Materials Innovation 3, 201-234, 2019