プロフィール詳細

プロジェクトを作成

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Dr. Suresh K.に依頼

India

Freelance | DFT | Computational Chemist | Molecular Docking | QSAR | MD Simulations | QM/MM | Molecular Modeling

プロフィール概要

Scientist of bioinformatics and computational biology, have more than 10 years' experience as a computational chemist using various computational techniques (DFT, QSAR, MD Simulations, Molecular Docking and QM/MM), Published more than 15 research articles in the relevant area in reputed Int'l journals with high impact factors like JACS| Chemical Science| JPC-A| etc. I have more than six years postdoctoral research experience in the area molecular modeling, drug designing, Bioinformatics, etc, during this period I handled multiple projects with large scale. My skills include electronic Structure Calculations using DFT, Molecular Docking Simulation, Bioinformatics, QSAR, MS-Excel, Python Programming and shell scripting in Linux using advanced computational techniques. I prepared my own scripts to perform Molecular Docking, DFT Calculations, MD, Simulations etc. in large amounts of target/protein/structures with fully automatically, no chance of error.

専門分野

• ☆ Molecular Modeling
• ☆ Molecular Docking
• ☆ Chemoinformatics
• ☆ Computational Chemistry
• ☆ Bioinformatics
• ☆ Python
• ☆ Excel
• ☆ R

サービス

• Writing
• Research
• Consulting
• Data & AI
• Product Development

Writing Clinical Trial Documentation, Technical Writing, Copywriting, Newswriting

Research Market Research, User Research, Meta-Research, Fact Checking, Gap Analysis, Gray Literature Search, Systematic Literature Review, Secondary Data Collection

Consulting Scientific and Technical Consulting

Data & AI Predictive Modeling, Statistical Analysis, Algorithm Design-Non ML, Data Visualization, Big Data Analytics, Data Processing, Data Insights

Product Development Formulation, Stability/Shelf Life Testing, Product Evaluation, Material Sourcing, Product Validation, Manufacturing, Concept Development, Prototyping

職務経験

Postdoctoral Fellow

BHU Varanasi

5月 2019 - 現在

Postdoctoral Fellow

Indian Institute of Technology Guwahati

10月 2016 - 4月 2019

学歴

Ph.D. (Applied Physics )

Babasaheb Bhimrao Ambedkar University

10月 2013 - 9月 2016

認定資格

• 認定資格の詳細は未入力です。

出版物

JOURNAL ARTICLE

SURESH KUMAR(2019). Electrical Power Generation from the Contrasting Interfacial Activities of Boron- and Nitrogen-Doped Reduced Graphene Oxide Membranes . ACS Applied Nano Materials. 2. (12). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 7997--8004. American Chemical Society ({ACS})

SURESH KUMAR(2019). pH-Regulated anion transport activities of bis(iminourea) derivatives across the cell and vesicle membrane . Organic & Biomolecular Chemistry. 17. (23). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 5779--5788. Royal Society of Chemistry ({RSC})

SURESH KUMAR(2018). Alkali metal-ion assisted Michael addition reaction in controlled tailoring of topography in a superhydrophobic polymeric monolith . Journal of Materials Chemistry A. 6. (35). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 17019--17031. Royal Society of Chemistry ({RSC})

SURESH KUMAR(2017). Assessing therapeutic potential of molecules: molecular property diagnostic suite for tuberculosis (MPDSTB) . Journal of Chemical Sciences. 129. (5). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 515--531. Springer Science and Business Media {LLC}

SURESH KUMAR(2015). Structure and Mechanism Leading to Formation of the Cysteine Sulfinate Product Complex of a Biomimetic Cysteine Dioxygenase Model . Chemistry - A European Journal. 21. (20). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 7470--7479. Wiley

SURESH KUMAR(2015). A comprehensive test set of epoxidation rate constants for iron (IV)–oxo porphyrin cation radical complexes . Chemical Science. 6. (2). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 1516--1529. Royal Society of Chemistry ({RSC})

SURESH KUMAR(2014). Long-Range Electron Transfer Triggers Mechanistic Differences between Iron(IV)-Oxo and Iron(IV)-Imido Oxidants . Journal of the American Chemical Society. 136. (49). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 17102--17115. American Chemical Society ({ACS})

SURESH KUMAR(2013). Comparison of the Reactivity of Nonheme Iron(IV)-Oxo versus Iron(IV)-Imido Complexes: Which is the Better Oxidant? . Angewandte Chemie International Edition. 52. (47). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 12288--12292. Wiley

SURESH KUMAR(2013). Rationalization of the Barrier Height for p-Z-styrene Epoxidation by Iron(IV)-Oxo Porphyrin Cation Radicals with Variable Axial Ligands . Inorganic Chemistry. 52. (14). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 7968--7979. American Chemical Society ({ACS})

SURESH KUMAR(2013). Mechanistic insight into halide oxidation by non-heme iron complexes. Haloperoxidase versus halogenase activity . Chemical Communications. 49. (93). Microsoft.AspNetCore.Mvc.Localization.LocalizedHtmlString 10926. Royal Society of Chemistry ({RSC})