科研速览 · Science Skim继续刷下去 · Keep skimming →
◆ Proceedings of the National Academy of Sciences2026-04-07· Computer science

Chemputer and chemputation—A universal chemical compound synthesis machine

Leroy Cronin, Sebastian Pagel, Abhishek Sharma

原始摘要(英文原文)· Original abstract
Chemputation treats chemical synthesis as the execution of reaction code on programmable hardware. We show that a Chemputer, equipped with an extensible set of reagents, catalysts, and process conditions, together with a compiler that maps reaction and hardware graphs, is universal. This means it can produce any stable, isolable molecule in finite time and detectable quantity, provided real-time error correction maintains sufficient step fidelity relative to the number of steps in the synthesis. We formalize this into a Chemical Synthesis Turing Machine (CSTM), which defines chemical execution through a unified description of reagents, process variables, and catalysts. The framework introduces the Universal Chemputation Principle and a dynamic error-correction scheme that enables fault-tolerant synthesis. Linking this framework to assembly theory strengthens the definition of a molecule by demanding practical synthesizability and error correction becomes a prerequisite for universality. We demonstrate the abstraction is universal with more than 100 χDL programs executed on modular Chemputers, from single-step reactions to multistep syntheses. In each case, the number of unit operations scales linearly with synthetic depth. These results establish programmable chemical synthesis, chemputation, as a subset of general computation where χDL programs are compiled to hardware, executed with closed-loop control, and yield verifiable molecular outputs. This formalization enables shareable chemical code, interoperable hardware, and a machine-verifiable, executable foundation for a searchable and formally provable map of chemical space.
读原文 · Read the paper ↗

AI 追问PRO

登录后使用 AI 追问

讨论区

登录后参与讨论

相关论文 · Related

Chemputer and chemputation—A universal chemical compound synthesis machine — 科研速览 Science Skim