Items where Author is "Srivastava, Hemant Kumar"

Article

Shukla, Gaurav ; Alam, Tipu ; Srivastava, Hemant Kumar ; Kumar, Ritush ; Patel, Bhisma K. (2019) Visible-Light-Mediated Ir(III)-Catalyzed Concomitant C3 Oxidation and C2 Amination of Indoles Organic Letters, 21 (10). pp. 3543-3547. ISSN 1523-7060

Sau, Prasenjit ; Rakshit, Amitava ; Alam, Tipu ; Srivastava, Hemant Kumar ; Patel, Bhisma K. (2019) tert-Butyl Nitrite Mediated Synthesis of 1,2,4-Oxadiazol-5(4H)-ones from Terminal Aryl Alkenes Organic Letters, 21 (13). pp. 4966-4970. ISSN 1523-7060

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

Higashibayashi, Shuhei ; Onogi, Satoru ; Srivastava, Hemant Kumar ; Sastry, G. Narahari ; Wu, Yao-Ting ; Sakurai, Hidehiro (2013) Stereoelectronic effect of curved aromatic structures: favoring the unexpected endo conformation of benzyli-substituted sumanene Angewandte Chemie International Edition, 52 (28). pp. 7314-7316. ISSN 1433-7851

Srivastava, Hemant Kumar ; Sastry, G. Narahari (2013) Efficient estimation of MMGBSA-based BEs for DNA and aromatic furan amidino derivatives Journal of Biomolecular Structure and Dynamics, 31 (5). pp. 522-537. ISSN 0739-1102

Srivastava, Hemant Kumar ; Bohari, Mohammed H. ; Sastry, G. Narahari (2012) Modeling anti-HIV compounds: the role of analogue-based approaches Current Computer Aided-Drug Design, 8 (3). pp. 224-248. ISSN 1573-4099

Srivastava, Hemant Kumar ; Sastry, G. Narahari (2012) Molecular dynamics investigation on a series of HIV protease inhibitors: assessing the performance of MM-PBSA and MM-GBSA approaches Journal of Chemical Information and Modeling, 52 (11). pp. 3088-3098. ISSN 1549-9596

Srivastava, Hemant Kumar ; Chinmayee, Choudhury ; Sastry, G. Narahari (2012) The efficacy of conceptual DFT descriptors and docking scores on the QSAR models of HIV protease inhibitors Medicinal Chemistry, 8 (5). pp. 811-825. ISSN 1573-4064

Srivastava, Hemant Kumar ; Chourasia, Mukesh ; Kumar, Devesh ; Sastry, G. Narahari (2011) Comparison of computational methods to model DNA minor groove binders Journal of Chemical Information and Modeling, 51 (3). pp. 558-571. ISSN 1549-9596

Srivastava, Hemant Kumar ; Sastry, G. Narahari (2011) Viability of clathrate hydrates as CO₂ capturing agents: a theoretical study The Journal of Physical Chemistry A, 115 (26). pp. 7633-7637. ISSN 1089-5639

Kamal, Ahmed ; Bharathi, E. Vijaya ; Ramaiah, M. Janaki ; Dastagiri, D. ; Reddy, J. Surendranadha ; Viswanath, A. ; Sultana, Farheen ; Pushpavalli, S. N. C. V. L. ; Pal-Bhadra, Manika ; Srivastava, Hemant Kumar ; Sastry, G. Narahari ; Juvekar, Aarti ; Sen, Subrata ; Zingde, Surekha (2010) Quinazolinone linked pyrrolo[2,1-c][1,4]benzodiazepine (PBD) conjugates: design, synthesis and biological evaluation as potential anticancer agents Bioorganic & Medicinal Chemistry, 18 (2). pp. 526-542. ISSN 0968-0896

Kamal, Ahmed ; Shankaraiah, Nagula ; Reddy, Ch. Ratna ; Prabhakar, S. ; Markandeya, Nagula ; Srivastava, Hemant Kumar ; Sastry, G. Narahari (2010) Synthesis of bis-1,2,3-triazolo-bridged unsymmetrical pyrrolobenzodiazepine trimers via ‘click’ chemistry and their DNA-binding studies Tetrahedron, 66 (29). pp. 5498-5506. ISSN 0040-4020