Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters

Bibliographic Details
Main Authors: Michal Roth, Yoni Toker, Dan T. Major
Format: Article
Language:English
Published: American Chemical Society 2023-12-01
Series:ACS Omega
Online Access:https://doi.org/10.1021/acsomega.3c07600
_version_ 1797360956745973760
author Michal Roth
Yoni Toker
Dan T. Major
author_facet Michal Roth
Yoni Toker
Dan T. Major
author_sort Michal Roth
collection DOAJ
first_indexed 2024-03-08T15:47:00Z
format Article
id doaj.art-a1b73fe7716444d1b0b9f340d6156e21
institution Directory Open Access Journal
issn 2470-1343
language English
last_indexed 2024-03-08T15:47:00Z
publishDate 2023-12-01
publisher American Chemical Society
record_format Article
series ACS Omega
spelling doaj.art-a1b73fe7716444d1b0b9f340d6156e212024-01-09T10:10:42ZengAmerican Chemical SocietyACS Omega2470-13432023-12-01911298130910.1021/acsomega.3c07600Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular ClustersMichal Roth0Yoni Toker1Dan T. Major2Department of Physics, Bar-Ilan University, Ramat-Gan, IsraelDepartment of Physics, Bar-Ilan University, Ramat-Gan, IsraelDepartment of Chemistry, Bar-Ilan University, Ramat-Gan, Israelhttps://doi.org/10.1021/acsomega.3c07600
spellingShingle Michal Roth
Yoni Toker
Dan T. Major
Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
ACS Omega
title Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
title_full Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
title_fullStr Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
title_full_unstemmed Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
title_short Monte Carlo-Simulated Annealing and Machine Learning-Based Funneled Approach for Finding the Global Minimum Structure of Molecular Clusters
title_sort monte carlo simulated annealing and machine learning based funneled approach for finding the global minimum structure of molecular clusters
url https://doi.org/10.1021/acsomega.3c07600
work_keys_str_mv AT michalroth montecarlosimulatedannealingandmachinelearningbasedfunneledapproachforfindingtheglobalminimumstructureofmolecularclusters
AT yonitoker montecarlosimulatedannealingandmachinelearningbasedfunneledapproachforfindingtheglobalminimumstructureofmolecularclusters
AT dantmajor montecarlosimulatedannealingandmachinelearningbasedfunneledapproachforfindingtheglobalminimumstructureofmolecularclusters