Role of vibrational spectroscopy in characterization of drug-ligand interaction
Vibrational spectroscopy plays an important role in characterization of drug-biomolecular complexes and aids in finding out potential compounds for new hybrid drugs of different kinds of diseases. Vibrational spectroscopy in combination with quantum chemical calculation and molecular modelling has r...
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sg-ntu-dr.10356-1443532020-11-02T08:26:07Z Role of vibrational spectroscopy in characterization of drug-ligand interaction Devi, Th.Gomti Asian Spectroscopy Conference 2020 Institute of Advanced Studies Science::Chemistry Raman FTIR Vibrational spectroscopy plays an important role in characterization of drug-biomolecular complexes and aids in finding out potential compounds for new hybrid drugs of different kinds of diseases. Vibrational spectroscopy in combination with quantum chemical calculation and molecular modelling has revolutionalised the field of spectroscopy in elucidating molecular fingerprint spectra, molecular parameters of the complexes, finding the best binding sites of the receptor and drug complexes. This in turns, assists in finding out the potential of the complexes to be a drug candidature. At this presentation, the interacting states of Estradiol-Tamoxifen drug, L-Threonine-Metformin drug shall be discussed. Published version 2020-10-29T13:11:43Z 2020-10-29T13:11:43Z 2020 Conference Paper Devi, T. G. (2020). Role of vibrational spectroscopy in characterization of drug-ligand interaction. Proc. Of the 7th Asian Spectroscopy Conference (ASC 2020). doi:10.32655/ASC_8-10_Dec2020.71 https://hdl.handle.net/10356/144353 10.32655/ASC_8-10_Dec2020.71 en © 2020 Nanyang Technological University. application/pdf |
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Science::Chemistry Raman FTIR Devi, Th.Gomti Role of vibrational spectroscopy in characterization of drug-ligand interaction |
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Vibrational spectroscopy plays an important role in characterization of drug-biomolecular complexes and aids in finding out potential compounds for new hybrid drugs of different kinds of diseases. Vibrational spectroscopy in combination with quantum chemical calculation and molecular modelling has revolutionalised the field of spectroscopy in elucidating molecular fingerprint spectra, molecular parameters of the complexes, finding the best binding sites of the receptor and drug complexes. This in turns, assists in finding out the potential of the complexes to be a drug candidature. At this presentation, the interacting states of Estradiol-Tamoxifen drug, L-Threonine-Metformin drug shall be discussed. |
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Asian Spectroscopy Conference 2020 |
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Asian Spectroscopy Conference 2020 Devi, Th.Gomti |
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Conference or Workshop Item |
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Devi, Th.Gomti |
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Devi, Th.Gomti |
title |
Role of vibrational spectroscopy in characterization of drug-ligand interaction |
title_short |
Role of vibrational spectroscopy in characterization of drug-ligand interaction |
title_full |
Role of vibrational spectroscopy in characterization of drug-ligand interaction |
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Role of vibrational spectroscopy in characterization of drug-ligand interaction |
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Role of vibrational spectroscopy in characterization of drug-ligand interaction |
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role of vibrational spectroscopy in characterization of drug-ligand interaction |
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2020 |
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https://hdl.handle.net/10356/144353 |
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