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H

Hema Tresa Varghese

University of Antwerp

38H指数
218论文数
3.7K被引数
收录论文 70
发表时间
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Spectroscopic (FT-IR, FT-Raman), first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis of N-[(4-(trifluoromethyl)phenyl]pyrazine-2-carboxamide by density functional methods
errARABIAN JOURNAL OF CHEMISTRY
IF5.2
err2017-05-01
err34
errOAAI
errJoseph, Tomy; Varghese, Hema Tresa; Panicker, C. Yohannan; Viswanathan, K.; Dolezal, Martin; Van Alsenoy, Christian
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Spectroscopic, DFT, molecular dynamics and molecular docking study of 1-butyl-2-(4-hydroxypheny1)-4,5-dimethyl-imidazole 3-oxide
errJOURNAL OF MOLECULAR STRUCTURE
IF4.7
err2017-04-01
err40
errOAAI
errBenzon, K. B.; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Armakovic, Stevan; Armakovic, Sanja J.; Pradhan, Kiran; Nanda, Ashis Kumar; Van Alsenoy, C.
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Vibrational spectroscopic analysis of cyanopyrazine-2-carboxamide derivatives and investigation of their reactive properties by DFT calculations and molecular dynamics simulations
errJOURNAL OF MOLECULAR STRUCTURE
IF4.7
err2017-03-01
err45
PREAI
errBeegum, Shargina; Mary, Y. Sheena; Varghese, Herria Tresa; Panicker, C. Yohannan; Armakovic, Stevan; Armakovic, Sanja J.; Zitko, Jan; Dolezal, Martin; Van Alsenoy, C.
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Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO-LUMO analysis and molecular docking study of 1-hydroxy-4,5,8-tris(4-methoxyphenyl) anthraquinone
errJOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS
IF4.9
err2015-12-01
err22
PREAI
errRenjith, R.; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Thiemann, Thies; Shereef, Anas; Al-Saadi, Abdulaziz A.
err分享
err收藏
FT-IR, HOMO-LUMO, NBO, MEP analysis and molecular docking study of 3-Methyl-4-{(E)-[4-(methylsulfanyl)-benzylidene]amino}1H-1,2,4-triazole-5(4H)-thione
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-12-01
err42
PREAI
errPanicker, C. Yohannan; Varghese, Hema Tresa; Manjula, P. S.; Sarojini, B. K.; Narayana, B.; War, Javeed Ahamad; Srivastava, S. K.; Van Alsenoy, C.; Al-Saadi, Abdulaziz A.
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Molecular structure, FT-IR, FT-Raman, NBO, HOMO and LUMO, MEP, NLO and molecular docking study of 2-[(E)-2-(2-bromophenyl)ethenyl]quinoline-6-carboxylic acid
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-12-01
err33
PREAI
errUlahannan, Rajeev T.; Panicker, C. Yohannan; Varghese, Hema Tresa; Musiol, Robert; Jampilek, Josef; Van Alsenoy, Christian; War, Javeed Ahmad; Srivastava, S. K.
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Spectroscopic and theoretical characterization of 2-(4-methoxyphenyl)-4,5-dimethyl-1H-imidazole 3-oxide
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-12-01
err37
PREAI
errBenzon, K. B.; Varghese, Hema Tresa; Panicker, C. Yohannan; Pradhan, Kiran; Tiwary, Bipransh Kumar; Nanda, Ashis Kumar; Van Alsenoy, C.
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Vibrational spectroscopic and molecular docking study of (2E)-N-(4-chloro-2-oxo-1,2-dihydroquinolin-3-yl)-3-phenylprop-2-enamide
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-12-01
err14
PREAI
errUlahannan, Rajeev T.; Panicker, C. Yohannan; Varghese, Hema Tresa; Musiol, Robert; Jampilek, Josef; Van Alsenoy, Christian; War, Javeed Ahmad; Al-Saadi, Abdulaziz A.
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Vibrational spectroscopic studies and molecular docking study of 2-[(E)-2-phenylethenyl]quinoline-5-carboxylic acid
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-11-01
err19
PREAI
errUlahannan, Rajeev T.; Panicker, C. Yohannan; Varghese, Hema Tresa; Musiol, Robert; Jampilek, Joseph; Van Alsenoy, Christian; War, Javeed Ahmad; Manojkumar, T. K.
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Vibrational spectra, HOMO, LUMO, NBO, MEP analysis and molecular docking study of 2,2-diphenyl-4-(piperidin-1-yl)butanamide
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-11-01
err67
PREAI
errMary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Girisha, M.; Sagar, B. K.; Yathirajan, H. S.; Al-Saadi, Abdulaziz A.; Van Alsenoy, Christian
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Molecular conformational analysis, vibrational spectra, NBO, NLO, HOMO-LUMO and molecular docking studies of ethyl 3-(E)-(anthracen-9-yl)prop-2-enoate based on density functional theory calculations
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-11-01
err43
PREAI
errMary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Thiemann, Thies; Al-Saadi, Abdulaziz A.; Popoola, Saheed A.; Van Alsenoy, C.; Al Jasem, Yosef
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Spectral investigations, DFT computations and molecular docking studies of 1,7,8,9-tetrachloro-10,10-dimethoxy-4-{3-[4-(2-methylphenyl)piperazin-1-yl]propyl}-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
errJOURNAL OF MOLECULAR STRUCTURE
IF4.7
err2015-10-01
err15
PREAI
errResmi, K. S.; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Pakosinska-Parys, Magdalena; Van Alsenoy, C.
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err收藏
Infrared spectrum, NBO, HOMO-LUMO, MEP and molecular docking studies (2E)-3-(3-nitrophenyl)-1-[4-piperidin-1-yl]prop-2-en-1-one
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-09-01
err27
PREAI
errPanicker, C. Yohannan; Varghese, Hema Tresa; Nayak, Prakash S.; Narayana, B.; Sarojini, B. K.; Fun, H. K.; War, Javeed Ahamad; Srivastava, S. K.; Van Alsenoy, C.
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FT-IR, NBO, HOMO-LUMO, MEP analysis and molecular docking study of Methyl N-({[2-(2-methoxyacetamido)-4-(phenylsulfanyl)phenyl]amino}[(methoxycarbonyl) imino]methyl)carbamate
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-09-01
err18
errOAAI
errPanicker, C. Yohannan; Varghese, Hema Tresa; Narayan, B.; Divya, K.; Sarojini, B. K.; War, Javeed Ahmad; Van Alsenoy, C.; Fun, H. K.
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1-Alkyl-1-methylpiperazine-1,4-diium salts: Synthetic, acid-base, XRD-analytical, FT-IR, FT-Raman spectral and quantum chemical study
errJOURNAL OF MOLECULAR STRUCTURE
IF4.7
err2015-08-01
err16
PREAI
errNemeckova, Dana; Mary, Y. Sheena; Panicker, C. Yohannan; Varghese, Hema Tresa; Van Alsenoy, Christian; Prochazkova, Marketa; Pazdera, Pavel; Al-Saadi, Abdulaziz A.
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Spectroscopic investigation (FT-IR and FT-Raman), vibrational assignments, HOMO-LUMO, NBO, MEP analysis and molecular docking study of 2-(4-hydroxyphenyl)-4,5-dimethyl-1H-imidazole 3-oxide
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-07-01
err28
PREAI
errBenzon, K. B.; Varghese, Hema Tresa; Panicker, C. Yohannan; Pradhan, Kiran; Tiwary, Bipransh Kumar; Nanda, Ashis Kumar; Van Alsenoy, C.
err分享
err收藏
Spectroscopic investigation (FT-IR, FT-Raman), HOMO-LUMO, NBO analysis and molecular docking study of 4-chlorophenyl quinoline-2-carboxylate
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-06-01
err23
PREAI
errFazal, E.; Panicker, C. Yohannan; Varghese, Hema Tresa; Nagarajan, S.; Sudha, B. S.; War, Javeed Ahamad; Srivastava, S. K.; Harikumar, B.; Anto, P. L.
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Vibrational spectroscopic and molecular docking study of 4-Methylphenylquinoline-2-carboxylate
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-05-01
err3
PREAI
errFazal, E.; Panicker, C. Yohannan; Varghese, Hema Tresa; Nagarajan, S.; Sudha, B. S.; War, Javeed Ahamad; Srivastava, S. K.; Harikumar, B.; Anto, P. L.
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Spectroscopic (FT-IR, FT-Raman), first order hyperpolarizability, NBO analysis, HOMO and LUMO analysis of 5-tert-Butyl-6-chloro-N-[(4-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2015-02-01
err15
PREAI
errBhagyasree, J. B.; Varghese, Hema Tresa; Panicker, C. Yohannan; Van Alsenoy, Christian; Al-Saadi, Abdulaziz A.; Dolezal, Martin; Samuel, Jadu
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err收藏
Vibrational spectra, molecular structure, NBO, HOMO-LUMO and first order hyperpoalarizability analysis of 1,4-bis(4-formylphenyl)anthraquinone by density functional theory
errSPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
IF4.6
err2014-10-01
err11
PREAI
errRenjith, R.; Mary, Y. Sheena; Varghese, Hema Tresa; Panicker, C. Yohannan; Thiemann, Thies; Van Alsenoy, Christian
err分享
err收藏

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