CJ on Mathematics and Science

When presenting RealQM for publication in a computational/quantum chemistry journal I meet the argument that RealQM cannot compete with the ...

The Grand Challenge of Quantum Chemistry  of  Ab Initio Computational Simulation of Protein Folding is today viewed to be way beyond reach, ...

 On the GitHub RealQM web page there are now new Bench Marks for Protein Folding. Take a look!

RealQM has been implemented with the help of Claude Code with the goal of simulating protein folding from first principles of atomic physic...

Rational physics is based on an idea of reductionism from complex physics on macro-scales to simple physics on micro-scales . But in moder...

With the help of Claude Code RealQM is now implemented in a version with active valence electrons which can be used for large molecules. A f...

Finally the dream of automatic computational solution of the partial differential equations of mathematical mechanics and physics has been a...

Chemists Model of Protein Molecule  This is a comment to the previous post on the relation between physics and chemistry.  Looking at the pi...

Computation has turned the philosophical idea of emergence into a virtual laboratory for exploration of large scale complex structures deve...

Protein folding is a spontaneous process where a given unique string of amino acids folds itself in a solvent (water) into a macromolecule...

The Nobel Prizes 2024 in Physics and Chemistry were given to the booming industry of AI/machine learning developed mainly outside traditiona...

The Nobel Prize in Chemistry 2024 was awarded for  Computational Protein Design by AI: AlphaFold2  with the following scientific background:...