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Shadrack Jabes Barnabas Email & Phone Number

Scientist, Cheminformatics at Digital Science
Location: Delhi, India 4 work roles 3 schools
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Current company
Digital Science
Role
Scientist, Cheminformatics
Location
Delhi, India
Company size
335 employees

Who is Shadrack Jabes Barnabas? Overview

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Shadrack Jabes Barnabas is listed as Scientist, Cheminformatics at Digital Science, a with 335 employees, based in Delhi, India. AeroLeads shows a matched LinkedIn profile for Shadrack Jabes Barnabas.

Shadrack Jabes Barnabas previously worked as Scientific Staff at Technische Universität Darmstadt, Center For Smart Interfaces, Department Of Chemistry and Scientific Staff at Freie Universität Berlin, Institute For Mathematics. Shadrack Jabes Barnabas holds Doctor Of Philosophy - Phd, Chemistry, 9.0/10.0 from Indian Institute Of Technology, Delhi.

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Digital Science

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About Shadrack Jabes Barnabas

Research scientist with a background in mathematics, statistics, programming logic, and experience in a wide variety of state-of-the-art theoretical techniques. Expertise in computational chemistry methodologies such as classical simulations with molecular and polarizable force fields, enhanced and free energy simulation techniques, development of novel multiscale molecular dynamics simulation methods.1. Proficient with several programming and scripting languages including Java, FORTRAN, Python, MATLAB, TCL, Bash.2. Worked in close collaboration with experimentalists.3. Experienced Scientific Writer (16 articles in international journals) and peer-reviewer.4. Planning and execution of several application and projects.5. Well versed with mathematical and statistical concepts such as principal component analysis, correlation analysis, linear, logistic regression analysis, shallow and deep learning technologies, ligand/structure based drug designing, 2D QSAR models.6. Independent researcher with strong communication skills

Listed skills include Chemistry, Computational Chemistry, Bioinformatics, Molecular Dynamics, and 15 others.

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Digital Science
Digital Science
Scientist, Cheminformatics
london, england, united kingdom
Website
digital-science.com
Employees
335
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4 roles

Shadrack Jabes Barnabas work experience

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Scientist, Cheminformatics

Current
Digital Science

Germany

Mar 2021 - Present

Scientific Staff

Technische Universität Darmstadt, Center For Smart Interfaces, Department Of Chemistry

Germany

1. Supported project head, together with an international team of ten colleagues, ininvestigating methods to model polymer solutions.2. Implemented: Indirect Umbrella Sampling (INDUS) in GROMACS, replica exchange molecular dynamics (REMD), thermodynamicintegration (TI), free energy perturbation techniques3. Collaborated with experts in chem engg. and chemistry within the group.4. Supervised and provided technical guidance to master graduates.5. Conducted statistical analysis of the samples collected from simulation.

Oct 2018 - Jan 2021

Scientific Staff

Freie Universität Berlin, Institute For Mathematics

Germany

1. Supported the project head, together with an international team of two colleagues, in investigating methods to model ionic liquids (ILs) and biomolecule aggregation process at the molecular level.2. Studied aggregation of biomolecules in water using multiscale simulation method and identified a novel strategy with improved computer efficiency.3. Work featured on the COVER of a prestigious Advanced theory and simulations journal.4. Invited to present my work at an international conference in Beijing, China.5. Collaborated with experts in mathematics and chemistry within FU.

Jun 2017 - Sep 2018

Visiting Research Scholar

Virginia Commonwealth University, Department Of Chemistry

United States

1. Supported the project head, in investigating fundamental aspects of solvation process in nanoparticles2. Simulated nanoparticle aggregation process and developed simple mathematical models which was successfully adopted to predict binding thermodynamics accurately as seen in simulations. This article was featured in a prestigious journal with a high impact factor of 9.3. Implemented thermodynamic integration, enhanced sampling techniques4. Supervised and provided research and technical guidance to visiting undergraduates.5. Administered lab supercomputers and was given the responsibility to Install and manage compilers, scientific packages, software libraries, etc and management of data.

May 2014 - Apr 2017
Team & coworkers

Colleagues at Digital Science

Other employees you can reach at digital-science.com. View company contacts for 335 employees →

MB Meghan Becker Meghan Becker Colleague at Digital ScienceNew York City Metropolitan Area, United States View → MN Megan Nunemaker Megan Nunemaker Colleague at Digital ScienceAthens, Ohio, United States View → CF Claire Fox Claire Fox Colleague at Digital ScienceLondon, England, United Kingdom View → TS Tim Steuer Tim Steuer Colleague at Digital ScienceDarmstadt, Hesse, Germany View → NZ Nicole Zielinski Nicole Zielinski Colleague at Digital ScienceBoston, Massachusetts, United States View → BH Becky Hoare Becky Hoare Colleague at Digital ScienceWootton, England, United Kingdom View → EJ Eden Jefford Eden Jefford Colleague at Digital ScienceGreater Cambridge Area, United Kingdom View → KS Katie Smith Katie Smith Colleague at Digital ScienceGoxhill, England, United Kingdom View → MS Martin Schmidt Martin Schmidt Colleague at Digital ScienceSchiffweiler, Saarland, Germany View → PH Phill Hall Phill Hall Colleague at Digital ScienceCambridge, England, United Kingdom View →
3 education records

Shadrack Jabes Barnabas education

Doctor Of Philosophy - Phd, Chemistry, 9.0/10.0

Indian Institute Of Technology, Delhi

1. Dissertation : Computer simulations of tetrahedral fluids and nanoparticle dispersions 2. CGPA : 9.0/10.0 3. Simulated nanoparticles.

Master'S Degree, Chemical Engineering, 8.74/10.0

National Institute Of Technology Rourkela

1. Dissertation : Design and study of SARS 3 CL protease inhibitors using molecular docking and QSAR 2. CGPA : 8.74/10.0 3. Creation.

Bachelor'S Degree, Chemical Engineering, 87% University Rank Holder

Anna University (Affiliated College)

Research: ”CuFe2O4 based materials as green anode for metallurgical applications” in Central ElectroChemical Research Institute (CECRI).

FAQ

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What company does Shadrack Jabes Barnabas work for?

Shadrack Jabes Barnabas works for Digital Science.

What is Shadrack Jabes Barnabas's role at Digital Science?

Shadrack Jabes Barnabas is listed as Scientist, Cheminformatics at Digital Science.

Where is Shadrack Jabes Barnabas based?

Shadrack Jabes Barnabas is based in Delhi, India while working with Digital Science.

What companies has Shadrack Jabes Barnabas worked for?

Shadrack Jabes Barnabas has worked for Digital Science, Technische Universität Darmstadt, Center For Smart Interfaces, Department Of Chemistry, Freie Universität Berlin, Institute For Mathematics, and Virginia Commonwealth University, Department Of Chemistry.

Who are Shadrack Jabes Barnabas's colleagues at Digital Science?

Shadrack Jabes Barnabas's colleagues at Digital Science include Meghan Becker, Megan Nunemaker, Claire Fox, Tim Steuer, and Nicole Zielinski.

How can I contact Shadrack Jabes Barnabas?

You can use AeroLeads to view verified contact signals for Shadrack Jabes Barnabas at Digital Science, including work email, phone, and LinkedIn data when available.

What schools did Shadrack Jabes Barnabas attend?

Shadrack Jabes Barnabas holds Doctor Of Philosophy - Phd, Chemistry, 9.0/10.0 from Indian Institute Of Technology, Delhi.

What skills is Shadrack Jabes Barnabas known for?

Shadrack Jabes Barnabas is listed with skills including Chemistry, Computational Chemistry, Bioinformatics, Molecular Dynamics, Molecular Modeling, Fortran, C++, and Python.

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