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As a Computational Biochemist my domain of interest in Computer-Aided Drug Designing utilizing my basic Degree of Master's in Biochemistry.Thorough my studies and as a researcher I worked on several projects utilizing various computational tools such as Homology Modeling of Proteins to reveal the 3D structure which hasn't been resolved by X-ray, NMR or Electron Microscopy etc. Active site or allosteric Characterization of proteins. Molecular modeling tools such as Docking, Pharmacophore mapping, Virtual screening, ADMET profiling etc. Another way of research is Reverse Docking Approach i.e. Target Prediction utilizing Drugs. Correlation studies between the experimental data and theoritical data. Qualitative Structure Relationship of the series of compounds to optimize the role of potency and unpotency of the compounds via Contour analysis. Dynamics Studies of the protein-Drug and Protein-Protein or SMPPI to observe the behavior of protein changes occurs in the body in microsecond scale of the time prividing optimum physiological conditions.
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Papers共 23 篇Author StatisticsCo-AuthorSimilar Experts
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Current computer-aided drug designno. 2 (2022): 110-119
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