Computational chemistry describes the use of computer modelling and simulation – including ab initio approaches based on quantum chemistry, and empirical approaches – to study the structures ...
Structural biology and computational chemistry can combine to accelerate the delivery of clinical candidates with excellent overall profiles. For instance, today it is possible to use state-of-the art ...
Develop an in-demand skill set combining a technical understanding of chemistry with expertise in computers and computation. A Bachelor of Science in Computational Chemistry and Chemical Informatics ...
In addition to an interest in computer modeling and statistical analysis methods, a career in computational chemistry requires patience, logical thinking, and attention to detail. “People skills” are ...
We are pleased to introduce the collection Frontiers in Chemistry – Theoretical and Computational Chemistry Editor’s Pick ...
We’re looking for highly motivated Ph.D.’s to fill two new postdoctoral associate positions in computational chemistry and who are interested in exploring conformational equilibrium of protein ...
A joint research team led by Yuuki Kubo and Shiji Tsuneyuki of the University of Tokyo has developed a new computational ...
Nobel Prize in Chemistry highlights AI-driven breakthroughs in computational protein design and structure prediction. Tools ...
This series comprises up-to-date and timely references for postgraduate students and practising chemists, covering all aspects of theoretical and computational chemistry, from current theoretical ...
This eBook delves into the science behind first-void urine, exploring its composition, collection methods, and the latest ...
XtalPi offers a suite of computational tools and platforms to advance pharmaceutical and new-materials research. Combining ...
A new method can improve treatment for patients with chronic myeloid leukemia by predicting which medication will be most ...