Molecular Learning of a Soft-Disks Fluid

Research output: Contribution to journalArticlepeer-review

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 languageEnglish (US)
Pages (from-to)283-301
Number of pages19
JournalInternational Journal of Unconventional Computing
Volume17
Issue number4
StatePublished - 2022
Externally publishedYes

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

Fingerprint

Dive into the research topics of 'Molecular Learning of a Soft-Disks Fluid'. Together they form a unique fingerprint.

Cite this