Items where Author is "Sharma, Bhaskar"

Article

Sharma, Bhaskar ; Neela, Y. Indra ; Narahari Sastry, G. (2016) Structures and energetics of complexation of metal ions with ammonia, water, and benzene: a computational study Journal of Computational Chemistry, 37 (11). pp. 992-1004. ISSN 0192-8651

Sharma, Bhaskar ; Srivastava, Hemant Kumar ; Gayatri, Gaddamanugu ; Sastry, Garikapati Narahari (2015) Energy decomposition analysis of cation-π, metal ion-lone pair, hydrogen bonded, charge-assisted hydrogen bonded, and π-π interactions Journal of Computational Chemistry, 36 (8). pp. 529-538. ISSN 0192-8651

Dinesh Kumar, Chinthapalli ; Sharma, Bhaskar ; Soujanya, Yarasi ; Chary, Vadla Naresh ; Patpi, Santhosh Reddy ; Kantevari, Srinivas ; Sastry, Garikapati Narahari ; Prabhakar, Sripadi (2014) Evaluating the cation binding strength and selectivity of calix[4]pyrroles: a computational and ESI-MS/MS study Physical Chemistry Chemical Physics, 16 (32). pp. 17266-17271. ISSN 1463-9076

Sharma, Bhaskar ; Umadevi, Deivasigamani ; Sastry, G. Narahari (2012) Contrasting preferences of N and P substituted heteroaromatics towards metal binding: probing the regioselectivity of Li⁺ and Mg²⁺ binding to (CH)_6−m−nN_mP_n Physical Chemistry Chemical Physics, 14 (40). pp. 13922-13932. ISSN 1463-9076

Sharma, Bhaskar ; Rao, J. Srinivasa ; Sastry, G. Narahari (2011) Effect of solvation on ion binding to imidazole and methylimidazole The Journal of Physical Chemistry A, 115 (10). pp. 1971-1984. ISSN 1089-5639