Abstract
This work is based on the Equivalence between Molecular Dynamics and Neural Network. It provides learning proofs in a Lennard-Jones (LJ) fluid, presented as a network of particles having non-bonded interactions. I describe the fluid’s learning as the property of an order that emerges as an adaptation in establishing equilibrium with energy and thermal conser-vation. The experimental section demonstrates the fluid can be trained with logic-gates patterns. The work goes beyond Molecular Computing’s application, explaining how this model uses its intrinsic minimizing properties in learning and predicting outputs. Finally, it gives hints for a theory on real chemistry’s computational universality.
Original language | English (US) |
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Pages (from-to) | 283-301 |
Number of pages | 19 |
Journal | International Journal of Unconventional Computing |
Volume | 17 |
Issue number | 4 |
State | Published - 2022 |
Externally published | Yes |
Keywords
- Lennard-Jones fluid
- logic-gates
- machine learning
- molecular computing
- molecular dynamics
- Molecular learning
- self-organizing systems
- thermodynamics
ASJC Scopus subject areas
- General Computer Science