Hemant Kumar Srivastava
Hemant Kumar Srivastava
National Institute of Pharmaceutical Education and Research Guwahati
Verified email at iitg.ac.in
Title
Cited by
Cited by
Year
Comparative QSAR study of phenol derivatives with the help of density functional theory
FA Pasha, HK Srivastava, PP Singh
Bioorganic & medicinal chemistry 13 (24), 6823-6829, 2005
982005
Peptide-like and small-molecule inhibitors against Covid-19
S Pant, M Singh, V Ravichandiran, USN Murty, HK Srivastava
Journal of Biomolecular Structure and Dynamics, 1-10, 2020
902020
Quinazolinone linked pyrrolo [2, 1-c][1, 4] benzodiazepine (PBD) conjugates: Design, synthesis and biological evaluation as potential anticancer agents
A Kamal, EV Bharathi, MJ Ramaiah, D Dastagiri, JS Reddy, A Viswanath, ...
Bioorganic & medicinal chemistry 18 (2), 526-542, 2010
862010
DFT-based QSAR study of testosterone and its derivatives
PP Singh, HK Srivastava, FA Pasha
Bioorganic & medicinal chemistry 12 (1), 171-177, 2004
842004
Molecular Dynamics Investigation on a Series of HIV Protease Inhibitors: Assessing the Performance of MM-PBSA and MM-GBSA Approaches
HK Srivastava, GN Sastry
Journal of Chemical Information and Modeling 52 (11), 3088-3098, 2012
752012
Comparison of computational methods to model dna minor groove binders
HK Srivastava, M Chourasia, D Kumar, GN Sastry
Journal of chemical information and modeling 51 (3), 558-571, 2011
742011
Atomic softness‐based QSAR study of testosterone
HK Srivastava, FA Pasha, PP Singh
International journal of quantum chemistry 103 (3), 237-245, 2005
542005
Calculation of transition dipole moment in fluorescent proteins—towards efficient energy transfer
T Ansbacher, HK Srivastava, T Stein, R Baer, M Merkx, A Shurki
Physical Chemistry Chemical Physics 14 (12), 4109-4117, 2012
532012
QSAR study of estrogens with the help of PM3‐based descriptors
FA Pasha, HK Srivastava, PP Singh
International journal of quantum chemistry 104 (1), 87-100, 2005
532005
Viability of Clathrate Hydrates as CO2 Capturing Agents: A Theoretical Study
HK Srivastava, GN Sastry
The Journal of Physical Chemistry A 115 (26), 7633-7637, 2011
462011
Synthesis of bis-1, 2, 3-triazolo-bridged unsymmetrical pyrrolobenzodiazepine trimers via ‘click’chemistry and their DNA-binding studies
A Kamal, N Shankaraiah, CR Reddy, S Prabhakar, N Markandeya, ...
Tetrahedron 66 (29), 5498-5506, 2010
402010
Analogue-based approaches in anti-cancer compound modelling: the relevance of QSAR models
MH Bohari, HK Srivastava, GN Sastry
Organic and medicinal chemistry letters 1 (1), 3, 2011
362011
Semiempirical QSAR study and ligand receptor interaction of estrogens
FA Pasha, HK Srivastava, PP Singh
Molecular diversity 9 (1-3), 215-220, 2005
352005
DFT based atomic softness and its application in site selectivity
PP Singh, FA Pasha, HK Srivastava
QSAR & Combinatorial Science 22 (8), 843-851, 2003
342003
QSTR Study of Small Organic Molecules Against Tetrahymena pyriformis
FA Pasha, HK Srivastava, A Srivastava, PP Singh
QSAR & Combinatorial Science 26 (1), 69-84, 2007
332007
Metal-Free Sequential C(sp2)–H/OH and C(sp3)–H Aminations of Nitrosoarenes and N-Heterocycles to Ring-Fused Imidazoles
A Purkait, SK Roy, HK Srivastava, CK Jana
Organic letters 19 (10), 2540-2543, 2017
292017
Stereoelectronic Effect of Curved Aromatic Structures: Favoring the Unexpected endo Conformation of Benzylic‐Substituted Sumanene
S Higashibayashi, S Onogi, HK Srivastava, GN Sastry, YT Wu, H Sakurai
Angewandte Chemie 125 (28), 7455-7457, 2013
292013
Benchmarking of different molecular docking methods for protein-peptide docking
P Agrawal, H Singh, HK Srivastava, S Singh, G Kishore, GPS Raghava
BMC Bioinformatics 19 (13), 426, 2019
252019
Modeling Anti-HIV Compounds: The Role of Analogue-Based Approaches
HK Srivastava, MH Bohari, GN Sastry
Current Computer-Aided Drug Design 8 (3), 224-248, 2012
222012
DFT based electrophilicity index and QSAR study of phenols as anti leukaemia agent
FA Pasha, HK Srivastava, Y Beg, PP Singh
American Journal of Immunology 2 (1), 23-28, 2006
202006
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