Items where Author is "Purushotham, Uppula"

Article

Purushotham, Uppula ; Zipse, Hendrik ; Sastry, G. Narahari (2016) A first-principles investigation of histidine and its ionic counterparts Theoretical Chemistry Accounts, 135 (7). Article ID 174, 16 pages. ISSN 1432-881X

Purushotham, Uppula ; Sastry, G. Narahari (2014) A comprehensive conformational analysis of tryptophan, its ionic and dimeric forms Journal of Computational Chemistry, 35 (8). pp. 595-610. ISSN 0192-8651

Kamal, Ahmed ; Shaik, Anver Basha ; Reddy, G. Narender ; Kumar, C. Ganesh ; Joseph, Joveeta ; Kumar, G. Bharath ; Purushotham, Uppula ; Sastry, G. Narahari (2014) Synthesis, biological evaluation, and molecular modeling of (E)-2-aryl-5-styryl-1,3,4-oxadiazole derivatives as acetylcholine esterase inhibitors Medicinal Chemistry Research, 23 (4). pp. 2080-2092. ISSN 1054-2523

Purushotham, Uppula ; Sastry, G. Narahari (2013) Conjugate acene fused buckybowls: evaluating their suitability for p-type, ambipolar and n-type air stable organic semiconductors Physical Chemistry Chemical Physics, 15 (14). pp. 5039-5048. ISSN 1463-9076

Kumar, C. Ganesh ; Mongolla, Poornima ; Sujitha, Pombala ; Joseph, Joveeta ; Babu, K. Suresh ; Suresh, Gangi ; Ramakrishna, Kallaganti Venkata Siva ; Purushotham, Uppula ; Sastry, G. Narahari ; Kamal, Ahmed (2013) Metabolite profiling and biological activities of bioactive compounds produced by Chrysosporium lobatum strain BK-3 isolated from Kaziranga National Park, Assam, India SpringerPlus, 2 (1). Article ID 122, 9 pages. ISSN 2193-1801

Purushotham, Uppula ; Vijay, Dolly ; Sastry, G. Narahari (2012) A computational investigation and the conformational analysis of dimers, anions, cations, and zwitterions of L-phenylalanine Journal of Computational Chemistry, 33 (1). pp. 44-59. ISSN 0192-8651

Purushotham, Uppula ; Sastry, G. Narahari (2012) Exploration of conformations and quantum chemical investigation of l-tyrosine dimers, anions, cations and zwitterions: a DFT study Theoretical Chemistry Accounts, 131 (2). Article ID 1093. ISSN 1432-881X

Higashibayashi, Shuhei ; Tsuruoka, Ryoji ; Soujanya, Yarasi ; Purushotham, Uppula ; Sastry, G. Narahari ; Seki, Shu ; Ishikawa, Takeharu ; Toyota, Shinji ; Sakurai, Hidehiro (2012) Trimethylsumanene: enantioselective synthesis, substituent effect on bowl structure, inversion energy and electron conductivity Bulletin of the Chemical Society of Japan, 85 (4). pp. 450-467. ISSN 0009-2673