| Interaction of anthraquinone anti-cancer drugs with DNA: Experimental and computational quantum chemical study JS Al-Otaibi, PT Spittle, TM El Gogary Journal of Molecular Structure 1127, 751-760, 2017 | 47 | 2017 |
| Substituents effect on the spectral studies on ruthenium (III) complexes of 5 (-4′-derivatives phenyldiazo)-3-phenyl-2-thioxo-4-thiazolidinone AZ El-Sonbati, AA El-Bindary, A El-Dissouky, TM El-Gogary, AS Hilali Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 58 (8 …, 2002 | 40 | 2002 |
| Interaction of psoralens with DNA-bases (I). An ab initio quantum chemical, density functional theory and second-order Møller–Plesset perturbational study TM El-Gogary, G Koehler Journal of Molecular Structure: THEOCHEM 808 (1-3), 97-109, 2007 | 39 | 2007 |
| Ab-Initio molecular geometry and normal coordinate analysis of pyrrolidine molecule TM El-Gogary, MS Soliman Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 57 (13 …, 2001 | 35 | 2001 |
| Noncovalent attachment of psoralen derivatives with DNA: Hartree–Fock and density functional studies on the probes TM El-Gogary, EM El-Gendy Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 59 (11 …, 2003 | 32 | 2003 |
| Geometry and thermodynamic stabilities of rhodanine tautomers and rotamers: Quantum chemical study AG Al-Sehemi, TM El-Gogary Journal of Molecular Structure: THEOCHEM 907 (1-3), 66-73, 2009 | 30 | 2009 |
| Temperature and substituent effects on the dissociation constants of 5-azorhodanine derivatives. Semi-empirical quantum mechanical calculation TM El-Gogary, AA El-Bindary, AS Hilali Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 58 (3 …, 2002 | 29 | 2002 |
| Spectroscopic studies of molecular interactions involving 2, 6-diethylaniline and N-ethylaniline donors and iodine as an electron acceptor in different solvents TM El-Gogary, MA Diab, SF El-Tantawy Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 66 (1 …, 2007 | 25 | 2007 |
| Synthesis of novel anthraquinones: Molecular structure, molecular chemical reactivity descriptors and interactions with DNA as antibiotic and anti-cancer drugs JS Al-Otaibi, TMEL Gogary Journal of Molecular Structure 1130, 799-809, 2017 | 22 | 2017 |
| Synthesis, characterization and quantum chemical ab initio calculations of new dimeric aminocyclodiphosph (V) azane and its Co (II), Ni (II) and Cu (II) complexes ANMA Alaghaz, AG Al-Sehemi, TM El-Gogary Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 95, 414-422, 2012 | 21 | 2012 |
| Computational studies on the thermodynamic and kinetic parameters of oxidation of 2-methoxyethanol biofuel via H-atom abstraction by methyl radical MA Abdel-Rahman, TM El-Gogary, N Al-Hashimi, MF Shibl, K Yoshizawa, ... Scientific reports 9 (1), 15361, 2019 | 19 | 2019 |
| Ab-initio molecular geometry and normal coordinate analysis of tetrahydrothiophene molecule TM El-Gogary Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 57 (7 …, 2001 | 19 | 2001 |
| Interaction of psoralens with DNA-bases (II): An ab initio quantum chemical, density functional theory and second-order MØller-Plesset perturbational study TM El-Gogary, G Koehler Journal of Molecular Structure: THEOCHEM 895 (1-3), 57-64, 2009 | 15 | 2009 |
| Molecular complexes of some anthraquinone anti-cancer drugs: experimental and computational study TM El-Gogary Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy 59 (5 …, 2003 | 15 | 2003 |
| Spectroscopic and quantum chemical studies on the structure of 2-arylquinoline-4 (1H)-thione derivatives MJ Mphahlele, AM El-Nahas, TM El-Gogary Journal of molecular structure 690 (1-3), 151-157, 2004 | 14 | 2004 |
| Ab initio-based kinetics of hydrogen atom abstraction from methyl propionate by H and CH3 radicals: a biodiesel model JS Al-Otaibi, MAM Mahmoud, AH Almuqrin, TM El-Gogary, ... Structural Chemistry 32, 1857-1872, 2021 | 13 | 2021 |
| First-principle kinetic studies of unimolecular pyrolysis of isopropyl esters as biodiesel surrogates TM El-Gogary, LA Heikal, MA Abdel-Rahman, AM El-Nahas Theoretical Chemistry Accounts 140, 1-15, 2021 | 12 | 2021 |
| Origin of reverse stability of diphosphouracil tautomers compared to their analogue uracil: DFT and ab initio study TM El-Gogary, AM El-Nahas Journal of Molecular Structure: THEOCHEM 851 (1-3), 54-62, 2008 | 11 | 2008 |
| Quantum chemical calculations and experimental investigations on 2-aminobenzoic acid-cyclodiphosph (V) azane derivative and its homo-binuclear Cu (II) complex TM El-Gogary, ANMA Alaghaz, RAA Ammar Journal of molecular structure 1011, 50-58, 2012 | 10 | 2012 |
| Theoretical and experimental studies on anticancer drug mitoxantrone JS Al-Otaibi, Y Wasli, TM ELGogary Journal of Molecular Structure 1173, 837-847, 2018 | 7 | 2018 |
