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Carlile Lavor
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2020 – today
- 2024
- [j68]Germano Abud, Jorge Alencar, Carlile Lavor, Leo Liberti, Antonio Mucherino:
An impossible combinatorial counting method in distance geometry. Discret. Appl. Math. 354: 83-93 (2024) - [j67]Michael Souza, Nilton Maia, Rômulo S. Marques, Carlile Lavor:
A Branch-and-Bound Algorithm for the Molecular Ordered Covering Problem. J. Comput. Biol. 31(6): 475-485 (2024) - [j66]Nektarios A. Valous, Eckhard Hitzer, Salvatore Vitabile, Swanhild Bernstein, Carlile Lavor, Derek Abbott, Maria Elena Luna-Elizarrarás, Wilder Bezerra Lopes:
Hypercomplex Signal and Image Processing: Part 1 [From the Guest Editors]. IEEE Signal Process. Mag. 41(2): 11-13 (2024) - [j65]Nektarios A. Valous, Eckhard Hitzer, Salvatore Vitabile, Swanhild Bernstein, Carlile Lavor, Derek Abbott, Maria Elena Luna-Elizarrarás, Wilder Bezerra Lopes:
Hypercomplex Signal and Image Processing: Part 2 [From the Guest Editors]. IEEE Signal Process. Mag. 41(3): 18-20 (2024) - 2023
- [j64]Leo Liberti, Gabriele Iommazzo, Carlile Lavor, Nelson Maculan:
Cycle-based formulations in Distance Geometry. Open J. Math. Optim. 4: 1-16 (2023) - [j63]Jaroslav Hrdina, Dietmar Hildenbrand, Ales Návrat, Christian Steinmetz, Rafael Alves, Carlile Lavor, Petr Vasík, Ivan Eryganov:
Quantum Register Algebra: the mathematical language for quantum computing. Quantum Inf. Process. 22(9): 328 (2023) - [c27]Michael Souza, Nilton Maia, Carlile Lavor:
The Ordered Covering Problem in Distance Geometry. ISBRA 2023: 255-266 - 2022
- [j62]Carlile Lavor, Rafael Alves, Leandro A. F. Fernandes:
Linear and geometric algebra approaches for sphere and spherical shell intersections in Rn. Expert Syst. Appl. 187: 115993 (2022) - [j61]Rodrigo Labiak, Carlile Lavor, Michael Souza:
Distance geometry and protein loop modeling. J. Comput. Chem. 43(5): 349-358 (2022) - [j60]Andrés D. Báez-Sánchez, Carlile Lavor, Antonio Mucherino:
Preface: special issue on optimization in distance geometry. J. Glob. Optim. 83(1): 1-2 (2022) - [j59]Phillip M. Duxbury, Carlile Lavor, Leo Liberti, Luiz Leduíno de Salles Neto:
Unassigned distance geometry and molecular conformation problems. J. Glob. Optim. 83(1): 73-82 (2022) - [j58]Carlile Lavor, Franklin L. Marquezino, Andrês Oliveira, Renato Portugal:
A quantum approach to the discretizable molecular distance geometry problem. Quantum Inf. Process. 21(7): 239 (2022) - 2021
- [j57]Douglas Soares Gonçalves, Carlile Lavor, Leo Liberti, Michael Souza:
A New Algorithm for the KDMDGP Subclass of Distance Geometry Problems with Exact Distances. Algorithmica 83(8): 2400-2426 (2021) - [j56]Carlile Lavor, Michael Souza, Luiz Mariano Carvalho, Douglas Soares Gonçalves, Antonio Mucherino:
Improving the sampling process in the interval Branch-and-Prune algorithm for the discretizable molecular distance geometry problem. Appl. Math. Comput. 389: 125586 (2021) - [j55]Carlile Lavor, Andrês Oliveira, Wagner Rocha, Michael Souza:
On the optimality of finding DMDGP symmetries. Comput. Appl. Math. 40(3) (2021) - [j54]Carlile Lavor, Michael Souza, José Luis Aragón:
Orthogonality of isometries in the conformal model of the 3D space. Graph. Model. 114: 101100 (2021) - [j53]Luiz Leduíno de Salles Neto, Carlile Lavor, Weldon A. Lodwick:
A note on the Cayley-Menger determinant and the Molecular Distance Geometry Problem. Inf. Sci. 559: 1-7 (2021) - [j52]Phillip M. Duxbury, Carlile Lavor, Luiz Leduíno de Salles Neto:
A conjecture on a continuous optimization model for the Golomb Ruler Problem. RAIRO Oper. Res. 55(4): 2241-2246 (2021) - [c26]Wagner Rocha, Carlile Lavor, Leo Liberti, Thérèse E. Malliavin:
Pseudo-dihedral Angles in Proteins Providing a New Description of the Ramachandran Map. GSI (2) 2021: 511-519 - [i7]Germano Abud, Jorge Alencar, Carlile Lavor, Leo Liberti, Antonio Mucherino:
An impossible utopia in distance geometry. CoRR abs/2110.01231 (2021) - 2020
- [j51]Antonio Mucherino, Carlile Lavor:
Preface: Special issue on distances in optimization and graphs dedicated to the memory of Michel Deza. Optim. Lett. 14(2): 269-271 (2020) - [j50]Germano Abud, Jorge Alencar, Carlile Lavor, Leo Liberti, Antonio Mucherino:
The K-discretization and K-incident graphs for discretizable Distance Geometry. Optim. Lett. 14(2): 469-482 (2020) - [j49]Luiz Leduíno de Salles Neto, Carlile Lavor, Weldon A. Lodwick:
A constrained interval approach to the generalized distance geometry problem. Optim. Lett. 14(2): 483-492 (2020) - [c25]Dietmar Hildenbrand, Christian Steinmetz, Rafael Alves, Jaroslav Hrdina, Carlile Lavor:
An Online Calculator for Qubits Based on Geometric Algebra. CGI 2020: 526-537 - [c24]Antonio Mucherino, Douglas Soares Gonçalves, Leo Liberti, Jung-Hsin Lin, Carlile Lavor, Nelson Maculan:
MD-jeep: a New Release for Discretizable Distance Geometry Problems with Interval Data. FedCSIS 2020: 289-294 - [i6]Leo Liberti, Gabriele Iommazzo, Carlile Lavor, Nelson Maculan:
Cycle-based formulations in Distance Geometry. CoRR abs/2006.11523 (2020) - [i5]Douglas Soares Gonçalves, Carlile Lavor, Leo Liberti, Michael Souza:
A new algorithm for the KDMDGP subclass of Distance Geometry Problems. CoRR abs/2009.05404 (2020)
2010 – 2019
- 2019
- [b3]Franklin de Lima Marquezino, Renato Portugal, Carlile Lavor:
A Primer on Quantum Computing. Springer Briefs in Computer Science, Springer 2019, ISBN 978-3-030-19065-1, pp. 1-105 - [j48]Jorge Alencar, Carlile Lavor, Leo Liberti:
Realizing Euclidean distance matrices by sphere intersection. Discret. Appl. Math. 256: 5-10 (2019) - [j47]Carlile Lavor, Leo Liberti, Bruce Randall Donald, Bradley Worley, Benjamin Bardiaux, Thérèse E. Malliavin, Michael Nilges:
Minimal NMR distance information for rigidity of protein graphs. Discret. Appl. Math. 256: 91-104 (2019) - [j46]Carlile Lavor, Michael Souza, Luiz Mariano Carvalho, Leo Liberti:
On the polynomiality of finding KDMDGP re-orders. Discret. Appl. Math. 267: 190-194 (2019) - [j45]Thérèse E. Malliavin, Antonio Mucherino, Carlile Lavor, Leo Liberti:
Systematic Exploration of Protein Conformational Space Using a Distance Geometry Approach. J. Chem. Inf. Model. 59(10): 4486-4503 (2019) - [j44]Leo Liberti, Carlile Lavor, Nelson Maculan:
A mathematical programming formulation for the Hartree-Fock problem on open-shell systems. Optim. Lett. 13(2): 429-437 (2019) - 2018
- [j43]Simon J. L. Billinge, Phillip M. Duxbury, Douglas Soares Gonçalves, Carlile Lavor, Antonio Mucherino:
Recent results on assigned and unassigned distance geometry with applications to protein molecules and nanostructures. Ann. Oper. Res. 271(1): 161-203 (2018) - [j42]Felipe Fidalgo, Douglas Soares Gonçalves, Carlile Lavor, Leo Liberti, Antonio Mucherino:
A symmetry-based splitting strategy for discretizable distance geometry problems. J. Glob. Optim. 71(4): 717-733 (2018) - [j41]Cláudio P. Santiago, Carlile Lavor, Sérgio Assunção Monteiro, Alberto Krone-Martins:
A new algorithm for the small-field astrometric point-pattern matching problem. J. Glob. Optim. 72(1): 55-70 (2018) - [j40]Bradley Worley, Florent Delhommel, Florence Cordier, Thérèse E. Malliavin, Benjamin Bardiaux, Nicolas Wolff, Michael Nilges, Carlile Lavor, Leo Liberti:
Tuning interval Branch-and-Prune for protein structure determination. J. Glob. Optim. 72(1): 109-127 (2018) - 2017
- [b2]Leo Liberti, Carlile Lavor:
Euclidean Distance Geometry - an Introduction. Springer undergraduate texts in mathematics and technology, Springer 2017, ISBN 978-3-319-60791-7, pp. 1-133 - [b1]Carlile Lavor, Leo Liberti, Weldon A. Lodwick, Tiago Mendonça da Costa:
An Introduction to Distance Geometry applied to Molecular Geometry. Springer Briefs in Computer Science, Springer 2017, ISBN 978-3-319-57182-9, pp. 1-49 - [j39]Claudia D'Ambrosio, Ky Khac Vu, Carlile Lavor, Leo Liberti, Nelson Maculan:
New Error Measures and Methods for Realizing Protein Graphs from Distance Data. Discret. Comput. Geom. 57(2): 371-418 (2017) - [j38]Tiago Mendonça da Costa, H. Bouwmeester, Weldon A. Lodwick, Carlile Lavor:
Calculating the possible conformations arising from uncertainty in the molecular distance geometry problem using constraint interval analysis. Inf. Sci. 415: 41-52 (2017) - [j37]Agostinho Agra, Rosa Figueiredo, Carlile Lavor, Nelson Maculan, António Pereira, Cristina Requejo:
Feasibility check for the distance geometry problem: an application to molecular conformations. Int. Trans. Oper. Res. 24(5): 1023-1040 (2017) - [j36]Douglas Soares Gonçalves, Antonio Mucherino, Carlile Lavor, Leo Liberti:
Recent advances on the interval distance geometry problem. J. Glob. Optim. 69(3): 525-545 (2017) - [c23]Michael Souza, Carlile Lavor, Rafael Alves:
Modeling the Molecular Distance Geometry Problem Using Dihedral Angles. ISBRA 2017: 270-278 - 2016
- [j35]Simon J. L. Billinge, Phillip M. Duxbury, Douglas Soares Gonçalves, Carlile Lavor, Antonio Mucherino:
Assigned and unassigned distance geometry: applications to biological molecules and nanostructures. 4OR 14(4): 337-376 (2016) - [j34]Bruno D. Amaro, Leonardo Silva de Lima, Carla Silva Oliveira, Carlile Lavor, Nair Abreu:
A note on the sum of the largest signless Laplacian eigenvalues. Electron. Notes Discret. Math. 54: 175-180 (2016) - [j33]Carlile Lavor, Marcelo Firer, José Mario Martínez, Leo Liberti:
Preface to the Special Issue on Many Faces of Distances. Int. Trans. Oper. Res. 23(5): 841 (2016) - [j32]Leo Liberti, Carlile Lavor:
Six mathematical gems from the history of distance geometry. Int. Trans. Oper. Res. 23(5): 897-920 (2016) - [j31]Douglas Soares Gonçalves, Márcia A. Gomes-Ruggiero, Carlile Lavor:
A projected gradient method for optimization over density matrices. Optim. Methods Softw. 31(2): 328-341 (2016) - [c22]Rafael Alves, Cipriano de Souza, Carlile Lavor:
Advances on the Geometric Algebra approach to the Discretizable Molecular Distance Geometry Problem (DMDGP). CGI (Short Papers) 2016: 85-88 - [c21]Antonio Mucherino, Warley Gramacho, Jung-Hsin Lin, Carlile Lavor:
A New Approach to the Discretization of Multidimensional Scaling. FedCSIS 2016: 591-599 - [i4]Claudia D'Ambrosio, Ky Khac Vu, Carlile Lavor, Leo Liberti, Nelson Maculan:
New error measures and methods for realizing protein graphs from distance data. CoRR abs/1607.00868 (2016) - [i3]Leo Liberti, Carlile Lavor:
Open research areas in distance geometry. CoRR abs/1610.00652 (2016) - 2015
- [j30]Andrea Cassioli, Benjamin Bardiaux, Guillaume Bouvier, Antonio Mucherino, Rafael Alves, Leo Liberti, Michael Nilges, Carlile Lavor, Thérèse E. Malliavin:
An algorithm to enumerate all possible protein conformations verifying a set of distance constraints. BMC Bioinform. 16: 23:1-23:15 (2015) - [j29]Antonio Mucherino, Rosiane de Freitas Rodrigues, Carlile Lavor:
Preface. Discret. Appl. Math. 197: 1-2 (2015) - [j28]Andrea Cassioli, Oktay Günlük, Carlile Lavor, Leo Liberti:
Discretization vertex orders in distance geometry. Discret. Appl. Math. 197: 27-41 (2015) - [j27]Jorge Alencar, Tibérius O. Bonates, Carlile Lavor, Leo Liberti:
An algorithm for realizing Euclidean distance matrices. Electron. Notes Discret. Math. 50: 397-402 (2015) - [c20]Leo Liberti, Grzegorz Swirszcz, Carlile Lavor:
Distance Geometry on the Sphere. JCDCGG 2015: 204-215 - 2014
- [j26]Leo Liberti, Benoît Masson, Jon Lee, Carlile Lavor, Antonio Mucherino:
On the number of realizations of certain Henneberg graphs arising in protein conformation. Discret. Appl. Math. 165: 213-232 (2014) - [j25]Pedro C. S. Lara, Renato Portugal, Carlile Lavor:
A new hybrid classical-quantum algorithm for continuous global optimization problems. J. Glob. Optim. 60(2): 317-331 (2014) - [j24]Virginia Costa, Antonio Mucherino, Carlile Lavor, Andrea Cassioli, Luiz Mariano Carvalho, Nelson Maculan:
Discretization orders for protein side chains. J. Glob. Optim. 60(2): 333-349 (2014) - [j23]Douglas Soares Gonçalves, Márcia A. Gomes-Ruggiero, Carlile Lavor:
Global convergence of diluted iterations in maximum-likelihood quantum tomography. Quantum Inf. Comput. 14(11-12): 966-980 (2014) - [j22]Leo Liberti, Carlile Lavor, Nelson Maculan, Antonio Mucherino:
Euclidean Distance Geometry and Applications. SIAM Rev. 56(1): 3-69 (2014) - [j21]Jeongyeon Seo, Jae-Kwan Kim, Joonghyun Ryu, Carlile Lavor, Antonio Mucherino, Deok-Soo Kim:
BetaMDGP: Protein Structure Determination Algorithm Based on the Beta-complex. Trans. Comput. Sci. 22: 130-155 (2014) - [c19]Jorge Alencar, Tibérius O. Bonates, Carlile Lavor:
A Combinatorial Approach to Multidimensional Scaling. BigData Congress 2014: 562-569 - [c18]Douglas Soares Gonçalves, Antonio Mucherino, Carlile Lavor:
An adaptive branching scheme for the Branch & Prune algorithm applied to Distance Geometry. FedCSIS 2014: 457-463 - 2013
- [j20]Michael Souza, Carlile Lavor, Albert Muritiba, Nelson Maculan:
Solving the molecular distance geometry problem with inaccurate distance data. BMC Bioinform. 14(S-9): S7 (2013) - [j19]Silas Sallaume, Simone de Lima Martins, Luiz Satoru Ochi, Warley Gramacho Da Silva, Carlile Lavor, Leo Liberti:
A discrete search algorithm for finding the structure of protein backbones and side chains. Int. J. Bioinform. Res. Appl. 9(3): 261-270 (2013) - [j18]Carlile Lavor, Leo Liberti, Antonio Mucherino:
The interval Branch-and-Prune algorithm for the discretizable molecular distance geometry problem with inexact distances. J. Glob. Optim. 56(3): 855-871 (2013) - [c17]Douglas Soares Gonçalves, Antonio Mucherino, Carlile Lavor:
Energy-based Pruning Devices for the BP Algorithm applied to Distance Geometry. FedCSIS 2013: 341-346 - [c16]Leo Liberti, Carlile Lavor, Jorge Alencar, Germano Abud:
Counting the Number of Solutions of KDMDGP Instances. GSI 2013: 224-230 - [c15]Rafael Alves, Andrea Cassioli, Antonio Mucherino, Carlile Lavor, Leo Liberti:
The integration of Clifford Algebra in the iBP algorithm for the DMDGP. IWBBIO 2013: 745-746 - [p2]Leo Liberti, Carlile Lavor, Antonio Mucherino:
The Discretizable Molecular Distance Geometry Problem seems Easier on Proteins. Distance Geometry 2013: 47-60 - [p1]Pedro Nucci, Loana Tito Nogueira, Carlile Lavor:
Solving the Discretizable Molecular Distance Geometry Problem by Multiple Realization Trees. Distance Geometry 2013: 161-176 - [e1]Antonio Mucherino, Carlile Lavor, Leo Liberti, Nelson Maculan:
Distance Geometry: Theory, Methods, and Applications. Springer 2013, ISBN 978-1-4614-5127-3 [contents] - 2012
- [j17]Carlile Lavor, Leo Liberti, Nelson Maculan, Antonio Mucherino:
The discretizable molecular distance geometry problem. Comput. Optim. Appl. 52(1): 115-146 (2012) - [j16]Carlile Lavor, Leo Liberti, Nelson Maculan, Antonio Mucherino:
Recent advances on the Discretizable Molecular Distance Geometry Problem. Eur. J. Oper. Res. 219(3): 698-706 (2012) - [j15]Antonio Mucherino, Carlile Lavor, Leo Liberti:
Exploiting Symmetry Properties of the Discretizable molecular Distance Geometry Problem. J. Bioinform. Comput. Biol. 10(3) (2012) - [j14]Carlile Lavor, Jon Lee, Audrey Lee-St. John, Leo Liberti, Antonio Mucherino, Maxim Sviridenko:
Discretization orders for distance geometry problems. Optim. Lett. 6(4): 783-796 (2012) - [j13]Antonio Mucherino, Carlile Lavor, Leo Liberti:
The discretizable distance geometry problem. Optim. Lett. 6(8): 1671-1686 (2012) - [j12]Douglas Soares Gonçalves, Márcia A. Gomes-Ruggiero, Carlile Lavor, Osvaldo Jiménez Farias, P. H. Souto Ribeiro:
Local solutions of maximum likelihood estimation in quantum state tomography. Quantum Inf. Comput. 12(9-10): 775-790 (2012) - [c14]Virginia Costa, Antonio Mucherino, Carlile Lavor, Luiz Mariano Carvalho, Nelson Maculan:
On suitable orders for discretizing Molecular Distance Geometry Problems related to protein side chains. FedCSIS 2012: 379-384 - [c13]Warley Gramacho, Antonio Mucherino, Carlile Lavor, Nelson Maculan:
A Parallel BP Algorithm for the Discretizable Distance Geometry Problem. IPDPS Workshops 2012: 1762-1768 - 2011
- [j11]Leo Liberti, Carlile Lavor, Antonio Mucherino, Nelson Maculan:
Molecular distance geometry methods: from continuous to discrete. Int. Trans. Oper. Res. 18(1): 33-51 (2011) - [j10]Carlile Lavor, Leo Liberti, Nelson Maculan:
A note on "A branch-and-prune algorithm for the molecular distance geometry problem". Int. Trans. Oper. Res. 18(6): 751-752 (2011) - [j9]Carlile Lavor, Antonio Mucherino, Leo Liberti, Nelson Maculan:
On the computation of protein backbones by using artificial backbones of hydrogens. J. Glob. Optim. 50(2): 329-344 (2011) - [j8]Michael Souza, Adilson Elias Xavier, Carlile Lavor, Nelson Maculan:
Hyperbolic smoothing and penalty techniques applied to molecular structure determination. Oper. Res. Lett. 39(6): 461-465 (2011) - [c12]Antonio Mucherino, Carlile Lavor, Leo Liberti:
A symmetry-driven BP algorithm for the Discretizable Molecular Distance Geometry Problem. BIBM Workshops 2011: 390-395 - [c11]Leo Liberti, Benoît Masson, Jon Lee, Carlile Lavor, Antonio Mucherino:
On the Number of Solutions of the Discretizable Molecular Distance Geometry Problem. COCOA 2011: 322-342 - [c10]Leo Liberti, Benoît Masson, Carlile Lavor, Antonio Mucherino:
Branch-and-Prune trees with bounded width. CTW 2011: 189-193 - [c9]Antonio Mucherino, Carlile Lavor, Therese E. Malliavin, Leo Liberti, Michael Nilges, Nelson Maculan:
Influence of Pruning Devices on the Solution of Molecular Distance Geometry Problems. SEA 2011: 206-217 - [i2]Leo Liberti, Carlile Lavor, Benoît Masson, Antonio Mucherino:
Polynomial cases of the Discretizable Molecular Distance Geometry Problem. CoRR abs/1103.1264 (2011) - 2010
- [c8]Antonio Mucherino, Carlile Lavor, Leo Liberti, El-Ghazali Talbi:
A parallel version of the Branch & Prune algorithm for the Molecular Distance Geometry Problem. AICCSA 2010: 1-6 - [c7]Carlile Lavor, Leo Liberti, Antonio Mucherino:
On the solution of molecular distance geometry problems with interval data. BIBM Workshops 2010: 77-82 - [c6]Antonio Mucherino, Leo Liberti, Carlile Lavor:
MD-jeep: An Implementation of a Branch and Prune Algorithm for Distance Geometry Problems. ICMS 2010: 186-197 - [i1]Leo Liberti, Benoît Masson, Jon Lee, Carlile Lavor, Antonio Mucherino:
On the number of solutions of the discretizable molecular distance geometry problem. CoRR abs/1010.1834 (2010)
2000 – 2009
- 2009
- [j7]Leo Liberti, Carlile Lavor, Nelson Maculan, Marco Antonio Chaer Nascimento:
Reformulation in mathematical programming: An application to quantum chemistry. Discret. Appl. Math. 157(6): 1309-1318 (2009) - [j6]Leo Liberti, Carlile Lavor, Nelson Maculan, Fabrizio Marinelli:
Double variable neighbourhood search with smoothing for the molecular distance geometry problem. J. Glob. Optim. 43(2-3): 207-218 (2009) - [c5]Antonio Mucherino, Carlile Lavor, Nelson Maculan:
The Molecular Distance Geometry Problem Applied to Protein Conformations. CTW 2009: 337-340 - [c4]Antonio Mucherino, Leo Liberti, Carlile Lavor, Nelson Maculan:
Comparisons between an exact and a metaheuristic algorithm for the molecular distance geometry problem. GECCO 2009: 333-340 - [c3]Carlile Lavor, Antonio Mucherino, Leo Liberti, Nelson Maculan:
Computing artificial backbones of hydrogen atoms in order to discover protein backbones. IMCSIT 2009: 759-764 - [c2]Carlile Lavor, Leo Liberti, Antonio Mucherino, Nelson Maculan:
On a discretizable subclass of instances of the molecular distance geometry problem. SAC 2009: 804-805 - [r1]Carlile Lavor, Leo Liberti, Nelson Maculan:
Molecular Distance Geometry Problem. Encyclopedia of Optimization 2009: 2304-2311 - 2008
- [j5]Milan Drazic, Carlile Lavor, Nelson Maculan, Nenad Mladenovic:
A continuous variable neighborhood search heuristic for finding the three-dimensional structure of a molecule. Eur. J. Oper. Res. 185(3): 1265-1273 (2008) - [j4]Ricardo dos Santos Carvalho, Carlile Lavor, Fábio Protti:
Extending the geometric build-up algorithm for the molecular distance geometry problem. Inf. Process. Lett. 108(4): 234-237 (2008) - [j3]Leo Liberti, Carlile Lavor, Nelson Maculan:
A Branch-and-Prune algorithm for the Molecular Distance Geometry Problem. Int. Trans. Oper. Res. 15(1): 1-17 (2008) - 2005
- [j2]Helio J. C. Barbosa, Carlile Lavor, Fernanda M. P. Raupp:
A GA-Simplex Hybrid Algorithm for Global Minimization of Molecular Potential Energy Functions. Ann. Oper. Res. 138(1): 189-202 (2005) - 2004
- [j1]Carlile Lavor, Nelson Maculan:
A Function to Test Methods Applied to Global Minimization of Potential Energy of Molecules. Numer. Algorithms 35(2-4): 287-300 (2004) - 2000
- [c1]Helio J. C. Barbosa, Fernanda M. P. Raupp, Carlile Lavor, H. Lima, Nelson Maculan:
A Hybrid Genetic Algorithm for Finding Stable Conformations of Small Molecules. SBRN 2000: 90-94