G. Narahari Sastry

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U. Deva PriyakumarProfessor, IIIT HyderabadEmail verificata su iiit.ac.in
Tandabany DinadayalaneProfessor of Chemistry, Clark Atlanta UniversityEmail verificata su icnanotox.org
Subha Mahadevi AlladiUniversity of Washington; IICT HyderabadEmail verificata su uw.edu
Dolly VijayDepartment of Chemistry, University of DelhiEmail verificata su chemistry.du.ac.in
Dr. Umadevi DeivasigamaniDST Scientist (WOSA), IIT PalakkadEmail verificata su tcd.ie
Vladimir PoroikovInstitute of Biomedical ChemistryEmail verificata su ibmc.msk.ru
Hemant Kumar SrivastavaNational Institute of Pharmaceutical Education and Research GuwahatiEmail verificata su iitg.ac.in
Soujanya Yarasi TirapatturCSIR-Indian Institute of Chemical TechnologyEmail verificata su iict.res.in
Dr Gaddamanugu GayatriGuru Nanak UniversityEmail verificata su gniindia.org
Dr. Devesh KumarBabasaheb Bhimrao Ambedkar University, LucknowEmail verificata su bbau.ac.in
Mukesh Chourasia (PhD)Amity University, NoidaEmail verificata su amity.edu
Dr. Purushotham Uppula Ph.D., FICSResearch scientist QSTATIX Pvt. Ltd.Email verificata su qstatix.co.in
Thomas Ballyprofessor for physical chemistry, University of Fribourg, SwitzerlandEmail verificata su unifr.ch
Sam de VisserUniversity of ManchesterEmail verificata su manchester.ac.uk
Sason ShaikProfessor of Chemistry, Institute of Chemistry, The Hebrew University of JerusalemEmail verificata su yfaat.ch.huji.ac.il
Prabhakar SripadiEx-Chief Scientist, Professor AcSIR, Department of Analytical & Structural ChemistryEmail verificata su iict.res.in
BANDARU SATEESHProfessor, Hangzhou Dianzi UniversityEmail verificata su hdu.edu.cn
Lagunin AlexeyИнститут биомедицинской химии им. В.Н. Ореховича РАМНEmail verificata su ibmc.msk.ru
Dr. Chinmayee ChoudhuryFaculty (Contractual), IISER, Mohali, IndiaEmail verificata su iisermohali.ac.in
Soumen SahaAssistant Professor, Department of Chemistry, Triveni Devi Bhalotia College, Raniganj, PaschimEmail verificata su tdbcollege.ac.in

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G. Narahari Sastry

Indian Institute of Technology Hyderabad

Email verificata su neist.res.in

artificial intelligence computational chemistry computational biology non-covalent interactions


Titolo Ordina per citazioni Ordina per anno Ordina per titolo	Citata da Citata da	Anno
Cation− π interaction: Its role and relevance in chemistry, biology, and material science AS Mahadevi, GN Sastry Chemical reviews 113 (3), 2100-2138, 2013	1105	2013
Cooperativity in noncovalent interactions AS Mahadevi, GN Sastry Chemical reviews 116 (5), 2775-2825, 2016	816	2016
Virtual screening in drug discovery-a computational perspective AS Reddy, SP Pati, PP Kumar, HN Pradeep, GN Sastry Current Protein and Peptide Science 8 (4), 329-351, 2007	450	2007
Incorrect dissociation behavior of radical ions in density functional calculations T Bally, GN Sastry The Journal of Physical Chemistry A 101 (43), 7923-7925, 1997	353	1997
Cation [M= H+, Li+, Na+, K+, Ca2+, Mg2+, NH4+, and NMe4+] interactions with the aromatic motifs of naturally occurring amino acids: a theoretical study AS Reddy, GN Sastry The Journal of Physical Chemistry A 109 (39), 8893-8903, 2005	315	2005
Quantum mechanical study of physisorption of nucleobases on carbon materials: graphene versus carbon nanotubes D Umadevi, GN Sastry The Journal of Physical Chemistry Letters 2 (13), 1572-1576, 2011	191	2011
Synthesis, DNA-binding ability and anticancer activity of benzothiazole/benzoxazole–pyrrolo [2, 1-c][1, 4] benzodiazepine conjugates A Kamal, KS Reddy, MNA Khan, RV Shetti, MJ Ramaiah, S Pushpavalli, ... Bioorganic & medicinal chemistry 18 (13), 4747-4761, 2010	185	2010
CLC-Pred: A freely available web-service for in silico prediction of human cell line cytotoxicity for drug-like compounds AA Lagunin, VI Dubovskaja, AV Rudik, PV Pogodin, DS Druzhilovskiy, ... PloS one 13 (1), e0191838, 2018	183	2018
What factors influence the rate constant of substrate epoxidation by compound I of cytochrome P450 and analogous iron (IV)-oxo oxidants? D Kumar, B Karamzadeh, GN Sastry, SP De Visser Journal of the American Chemical Society 132 (22), 7656-7667, 2010	183	2010
Noncovalent interaction of carbon nanostructures D Umadevi, S Panigrahi, GN Sastry Accounts of chemical research 47 (8), 2574-2581, 2014	182	2014
Exploring the size dependence of cyclic and acyclic π-systems on cation–π binding D Vijay, GN Sastry Physical Chemistry Chemical Physics 10 (4), 582-590, 2008	175	2008
Comprehensive Study on the Solvation of Mono- and Divalent Metal Cations: Li⁺, Na⁺, K⁺, Be²⁺, Mg²⁺ and Ca²⁺ JS Rao, TC Dinadayalane, J Leszczynski, GN Sastry The Journal of Physical Chemistry A 112 (50), 12944-12953, 2008	155	2008
The cooperativity of cation–π and π–π interactions D Vijay, GN Sastry Chemical Physics Letters 485 (1-3), 235-242, 2010	153	2010
Choline kinase: an important target for cancer S Janardhan, P Srivani, GN Sastry Current medicinal chemistry 13 (10), 1169-1186, 2006	141	2006
On the cooperativity of cation− π and hydrogen bonding interactions D Vijay, H Zipse, GN Sastry The Journal of Physical Chemistry B 112 (30), 8863-8867, 2008	140	2008
Explicit solvent effect on cation− π interactions: a first principle investigation JS Rao, H Zipse, GN Sastry The Journal of Physical Chemistry B 113 (20), 7225-7236, 2009	129	2009
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	127	2012
Molecular and Ionic Interaction with Graphene Nanoflakes: A Computational Investigation of CO₂, H₂O, Li, Mg, Li⁺, and Mg²⁺ Interaction with Polycyclic Aromatic … D Umadevi, GN Sastry The Journal of Physical Chemistry C 115 (19), 9656-9667, 2011	122	2011
A computational study of cation–π interactions in polycyclic systems: exploring the dependence on the curvature and electronic factors UD Priyakumar, M Punnagai, GPK Mohan, GN Sastry Tetrahedron 60 (13), 3037-3043, 2004	118	2004
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	112	2010

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