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Experience with computational chemistry software, such as protein structure viewers, ChemAxon toolkits, RDKit, and KNIME

Requisition Id10532 Overview: We are seeking a Group Leader for the Advanced Computing for Chemistry and Materials group within the Science Engagement section in the National Center for Computational Sciences (NCCS).NCCS Provides state-of-the-art computational and data science infrastructure coupled with dedicated scientific and technical professionals tackling large-scale problems across a broad range of scientific domains for accelerating scientific discovery and engineering advances.

To be successful you will have a PhD (or within six months of completion) or equivalent professional qualifications and experience in Physical Chemistry or Chemical Physics and a demonstrable understanding and knowledge of ultrafast laser technology and spectroscopy.

As Research Fellow, you will carry out independent and/or team research which has a significant impact in the area of your specialisation. You will plan, develop and engage in high quality research projects that are aligned with the University’s research focus areas and those of the Computational Materials Chemistry Group, led by Professor Michelle Spencer.

Candidates should have, or be close to completing, a PhD in computational chemistry or a related area, and they should have a strong background in cheminformatics and/or machine learning.

Seize the opportunity to become a driving force behind digitalization and innovation in the cutting-edge field of computational chemistry. In the role as a skilled Business Consultant, you will act as a liaison between Research and IT, shaping the future of NME Drug Design and crafting effective, efficient technical solutions for our global partners.

We are seeking an experienced and passionate Computational Chemist to join Kymera Therapeutics. The successful candidate will apply cutting-edge computational chemistry and cheminformatics approaches, in combination with medicinal chemistry design principles, to support our platform and pipeline projects. As a technical lead, you will be critically contributing to all aspects of drug discovery. You will also contribute to our unique discovery engine to design highly efficient, selective, and potent degraders. This is a truly unique opportunity to be at the forefront of the targeted protein degradation space.

You will engage in early drug discovery projects from launch to preclinical development and help our efforts in advancing new therapeutics to patients. You will be at the forefront of developing new approaches that reimagine small molecule drug discovery leveraging Recursion’s extensive data capabilities.

We are looking for a highly motivated computational chemist to join the Computational Chemistry group at our R&D site in Jealott's Hill, UK. The role offers an exciting opportunity to work on chemistry design problems in a multidisciplinary environment, with applications in a wide range of biological systems spanning plant, mammalian and invertebrate biology.

We are looking for a talented and ambitious computational chemist who is passionate about making a difference in cancer care and loves working in the startup environment. Apply your expertise in Chemistry, Computational Chemistry, Cheminformatics or a related discipline in establishing the company’s capabilities in molecular design and drug development.

Applicants should preferably hold a Ph.D. in the relevant subject from reputed Institutions.

Faculty of Chemistry at the Nicolaus Copernicus University in Toruń, Poland, invites applications for assistant professor positions in the general field of computational chemistry, quantum chemistry, theoretical spectroscopy, materials modeling. The candidate’s research profile should complement and connect with the existing expertise of the Molecular Modeling Group in the De- partment of Chemistry of Materials, Adsorption and Catalysis.

We are seeking a Postdoctoral Research Associate who will support the Advanced Computing for Chemistry and Materials in the National Center for Computational Sciences (NCCS), Computing and Computational Sciences Directorate (CCSD) at Oak Ridge National Laboratory (ORNL) to perform leading-edge computational materials research and development.

The project focuses on the computational study of the effects of pressure on the Woodward-Hoffmann rules, organocatalysis, tunnelling, and nanothread formation mechanism. The candidate will work on computing potential energy surfaces of organic reactions under pressure using the eXtreme Pressure-Polarizable Continuum Model (XP-PCM) method.

We are seeking to appoint a Lecturer, Senior Lecturer or Reader in Computational Chemistry, as part of our ongoing investment and expansion in research excellence. You will be expected to develop an innovative teaching and research portfolio in Computational Chemistry, publishing world-class research that will lead to a successful externally funded research program supporting postdoctoral research staff and PhD students, and establishing links with industry.

The project focuses on the computational study of the effects of pressure on the Woodward-Hoffmann rules, organocatalysis, tunnelling, and nanothread formation mechanism. The candidate will work on computing potential energy surfaces of organic reactions under pressure using the eXtreme Pressure-Polarizable Continuum Model (XP-PCM) method.

A background in theory underlying computational investigations: molecular-mechanics/quantum-mechanics/thermochemistry is desired.

Our company is seeking a creative, self-motivated computational chemist with exceptional interpersonal and problem-solving skills to join the Modeling group in Kenilworth, NJ, part of the Computational and Structural Chemistry (CSC) department. We are looking to expand our capability in peptide computational chemistry to support our future peptide strategy.

The AFRL Materials and Manufacturing Directorate seeks to hire a motivated and experienced engineer or scientist to conduct computational polymer physics research & development in the Polymers & Specialty Materials Branch of the Photonic, Electronics, and Soft Materials Division.