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 ...
Avogadro libraries provide 3D rendering, visualization, analysis and data processing useful in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas.
Having access to the latest versions of a broad range of software is vital if computational chemistry groups are to be at the cutting edge of research and development. Add to this the fact that ...
A next generation quantum chemistry and crystallography program and library. Note: occ is in early development, and is undergoing substantial changes regularly - it is not stable, and features are ...
Like Sydney Altman 1, I too was initially rejected by the renowned Medical Research Council (MRC) Laboratory of Molecular Biology in Cambridge, England. The year was 1967 and I was then in my ...