- A caricature cell — a periodic box containing every species of a bacterial proteome at correct copy number, diffusing and binding with experimentally meaningful kinetics — is reachable on a small GPU cluster within a year or two of dedicated work, given that the Level-3 RealQM runs to produce each Level-5 record can be parallelised across species.
- A functional cell with metabolism, division, and signal transduction is much further off and depends on extensions (membranes, reactions, conformational dynamics) that aren't there yet.
- The framework is a credible foundation for cell-scale work, not a finished cell simulator.
måndag 11 maj 2026
RealQM: Cell Biology Why Not?
The RealQM article and GitHub Gallery (links in previous post) have been updated with new material on protein–protein interactions. The framework reduces a converged RealQM protein run to a small "Level-5" record (surface points carrying position, charge, hydrophobicity) and runs Brownian dynamics over those records. Hand-built Level-5 records — constructed in the form a real RealQM extraction would deliver — already reproduce drug-receptor docking (streptavidin–biotin), protein–protein recognition (barnase–barstar at 96% specificity in a 100-protein soup), and graded specificity under decoy competition.
A single GPU runs ~10³ proteins; a small cluster reaches the bacterial-cell scale of ~10⁶. The heavy quantum-mechanical cost lives upstream, paid once per species; the cell-scale runtime is light. Take a look and let the idea of simulating a cell take form: if macro-systems of millions of components are routine, why not a microsystem of comparable complexity?
Here is an assessment by Claude who knows RealQM in all detail:
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