9 Molecular Dynamics Jobs

We are looking for a highly skilled and experienced Postdoctoral Research Associate in Single-Molecule Biophysics to join our team at the University of York Computer Science. The ideal candidate will have a strong background in biophysics and a passion for working with single-molecule systems. Roles and Responsibility Conduct experiments and analyze data to study the behavior of single-molecule systems. Develop and implement new methods and techniques to improve experimental efficiency. Collaborate with cross-functional teams to design and execute research projects. Interpret complex data sets and draw meaningful conclusions. Stay updated with the latest developments in the field of biophysi...

Dear Aspirant, TCS Hiring- Scientist for R&D in emulation/data science Location : Mumbai/ Kolkata/ Pune/Chennai Experience : 10 years overall experience, spread across a combination of manufacturing industry, consulting, information & technology services. Minimum of 5 years in IT/ Consulting Technical Skill: Modeling using molecular dynamics (MD) simulation tools such as GROMACS/Amber/OpenMD etc.; Familiarity with basic computational chemistry for organic and inorganic compounds, polymers, organometallic molecules; Understanding of ML tools as applicable to chemistry R&D including cheminformatic tools such as RDKit, MDG etc. Must have Skill : Technical Ability to work with opensource models ...

Join Aganitha and contribute to the discovery of medicines that will impact lives! Aganitha, at the forefront of co-innovation with global clients, is shaping next-generation R&D in diverse industries. As a Scientist at Aganitha, you will leverage cutting-edge advances in computational chemistry, materials science, soft matter physics, AI/ML, and high-performance computing in the Cloud. You will collaborate closely with research leaders at client organizations, drive solutions from concept to launch, and interact with external vendors for experimental validation. **Key Responsibilities** - Perform advanced computational simulations to understand stability and design principles relevant to va...

0.6 - 4 years with In depth knowledge and skill set pertaining to Molecular Modelling, Docking, Molecular mechanics, Quantum Mechanism, Molecular Dynamics simulation and QM/MM simulations is must. Brief knowledge/ experience of protein structure, function, dynamics and engineering. Sound knowledge in programming and scripting languages like Fortran, C, C++, Perl and Python. Putting theory into practice Are you inquisitiveFinally looking for a place to put your expert skills in MD, QM, MM to solve real world problemsYou have arrived at the right place.

0.6 - 4 years with In depth knowledge and skill set pertaining to Molecular Modelling, Docking, Molecular mechanics, Quantum Mechanism, Molecular Dynamics simulation and Quantum mechanics/Molecular mechanics simulations is must. Brief knowledge/ experience of protein structure, function, dynamics and engineering. Sound knowledge in programming and scripting languages like Fortran, C, C++, Perl and Python. Putting theory into practice Are you inquisitiveFinally looking for a place to put your expert skills in Molecular Dynamics, uantum mechanics, Molecular mechanics to solve real world problemsYou have arrived at the right place.

About Us: InSilicoMinds is a leader in the application of computational modeling and simulation (CM&S) for pharmaceutical research and development. We focus on harnessing cutting-edge in silico technologies to streamline drug design, formulation development, and regulatory submissions. Our innovative approaches help to accelerate drug discovery while optimizing formulations and ensuring high-quality manufacturing processes. Position Overview: We are looking for a highly skilled and motivated Computational Chemistry Expert with hands-on experience in retrosynthesis and reaction simulation. The ideal candidate will have deep expertise in computational chemistry tools and software, with a focus...

This job opportunity is based in Australia at the University of New South Wales (UNSW) Sydney, in collaboration with ANSTO (Australia), Imperial College London (UK), and Tokamak Energy (UK). The research program focuses on developing new materials for compact tokamak reactors and predicting their degradation over time. We are currently looking for a Postdoctoral Research Associate / Senior Research Associate to join our team and contribute to the modeling aspect of this initiative. In this collaborative role, you will be responsible for developing multi-scale models, ranging from the atomistic to the meso-scale, and conducting simulations to support the model. The main objective is to gain n...

Design and execute MD simulations of proteins in various solvent environments Prepare protein structures, system setup, solvation, and equilibration Perform a comprehensive analysis of MD trajectories to extract meaningful dynamic insights Required Candidate profile Hands-on experience with molecular dynamics simulations Experience with GROMACS (topology generation, mdrun, analysis tools) or other MD packages (AMBER, NAMD, OpenMM)

Role & responsibilities We are seeking a highly motivated and research-oriented candidate to join our research team. The ideal candidate will primarily engage in computational design/engineering of industrial enzymes. The candidate will also perform NGS data analysis and AI/ML model development Preferred candidate profile Candidate should have in-depth knowledge of sequence analysis, homology modeling, molecular docking and molecular dynamics. Prior experience of enzyme engineering would be surplus Basic knowledge of python programming language, machine learning and NGS data analysis Experience 1 Year academic/Industrial MSc or M.Tech in Bioinformatics