A global optimization perspective on molecular clusters

JMC Marques, FB Pereira… - … of the Royal …, 2017 - royalsocietypublishing.org
Although there is a long history behind the idea of chemical structure, this is a key concept
that continues to challenge chemists. Chemical structure is fundamental to understanding …

Script and language identification from document images

GS Peake, TN Tan - … on Document Image Analysis (DIA'97), 1997 - ieeexplore.ieee.org
In this paper we present a detailed review of current script and language identification
techniques. The main criticism of the existing techniques is that most of them rely on either …

EasyWheel-A mobile social navigation and support system for wheelchair users

C Menkens, J Sussmann, M Al-Ali… - 2011 Eighth …, 2011 - ieeexplore.ieee.org
Large cities are built and designed based on the needs of mobile people, architectural
preferences and budgets. Unfortunately, this constitutes a big disadvantaged for those with …

A study on diversity for cluster geometry optimization

FB Pereira, JMC Marques - Evolutionary Intelligence, 2009 - Springer
Diversity is a key issue to consider when designing evolutionary approaches for difficult
optimization problems. In this paper, we address the development of an effective hybrid …

How different are two chemical structures?

JMC Marques, JL Llanio-Trujillo… - Journal of Chemical …, 2010 - ACS Publications
We extend the scope of a recent method for superimposing two molecules (J. Chem. Phys.
2009, 131, 124126-1− 124126-10) to include the identification of chiral structures. This …

[图书][B] Soft computing in chemical and physical sciences: a shift in computing paradigm

K Sarkar, SP Bhattacharyya - 2017 - taylorfrancis.com
This book can be regarded as' Soft computing for physicists and chemists self-taught'. It
prepares the readers with a solid background of soft computing and how to adapt soft …

Colloidal clusters from a global optimization perspective

JMC Marques, FB Pereira - Journal of Molecular Liquids, 2015 - Elsevier
Modern microscopy techniques opened new perspectives to look at colloidal clusters. It is
now possible to visualize the colloidal particles forming the cluster, which provides relevant …

New insights on lithium-cation microsolvation by solvents forming hydrogen-bonds: Water versus methanol

JL Llanio-Trujillo, JMC Marques, FB Pereira - … and Theoretical Chemistry, 2013 - Elsevier
This investigation uses a recent methodology, essentially based on our evolutionary
algorithm (EA) to get new insights about the energetics and structure of the first solvation …

Microsolvation of the potassium ion with aromatic rings: comparison between hexafluorobenzene and benzene

JMC Marques, JL Llanio-Trujillo, M Albertí… - The Journal of …, 2013 - ACS Publications
We employ a recently developed methodology to study structural and energetic properties of
the first solvation shells of the potassium ion in nonpolar environments due to aromatic rings …

Designing efficient evolutionary algorithms for cluster optimization: A study on locality

FB Pereira, JMC Marques, T Leitão… - Advances in metaheuristics …, 2008 - Springer
Cluster geometry optimization is an important problem from the Chemistry area. Hybrid
approaches combining evolutionary algorithms and gradient-driven local search methods …