Exploration of the chemical space and its three historical regimes EJ Llanos, W Leal, DH Luu, J Jost, PF Stadler, G Restrepo Proceedings of the National Academy of Sciences 116 (26), 12660-12665, 2019 | 118 | 2019 |
Topological study of the periodic system G Restrepo, H Mesa, EJ Llanos, JL Villaveces Journal of Chemical Information and Computer Sciences 44 (1), 68-75, 2004 | 66 | 2004 |
Topological space of the chemical elements and its properties G Restrepo, EJ Llanos, H Mesa Journal of mathematical chemistry 39, 401-416, 2006 | 33 | 2006 |
Electronic energy and multipolar moments characterize amino acid side chains into chemically related groups HJ Bohórquez, M Obregón, C Cárdenas, E Llanos, C Suárez, ... The Journal of Physical Chemistry A 107 (47), 10090-10097, 2003 | 30 | 2003 |
How frequently do clusters occur in hierarchical clustering analysis? A graph theoretical approach to studying ties in proximity W Leal, EJ Llanos, G Restrepo, CF Suárez, ME Patarroyo Journal of cheminformatics 8, 1-16, 2016 | 26 | 2016 |
Quantum chemical analysis explains hemagglutinin peptide–MHC Class II molecule HLA-DRβ1* 0101 interactions C Cárdenas, JL Villaveces, H Bohórquez, E Llanos, C Suárez, M Obregón, ... Biochemical and biophysical research communications 323 (4), 1265-1277, 2004 | 25 | 2004 |
Three dissimilarity measures to contrast dendrograms G Restrepo, H Mesa, EJ Llanos Journal of chemical information and modeling 47 (3), 761-770, 2007 | 21 | 2007 |
The expansion of chemical space in 1826 and in the 1840s prompted the convergence to the periodic system W Leal, EJ Llanos, A Bernal, PF Stadler, J Jost, G Restrepo Proceedings of the National Academy of Sciences 119 (30), e2119083119, 2022 | 14 | 2022 |
Constructing a useful tool for characterizing amino acid conformers by means of quantum chemical and graph theory indices C Cárdenas, M Obregón, EJ Llanos, E Machado, HJ Bohórquez, ... Computers & chemistry 26 (6), 667-682, 2002 | 14 | 2002 |
The chemical space from which the periodic system arose W Leal, EJ Llanos, PF Stadler, J Jost, G Restrepo | 9 | 2019 |
La investigación en Uniandes 2007. Elementos para una política J Villaveces, L Orozco, D Chavarro, C Ruiz, E Llanos, A Silva, S Daza Vicerrectoría de Investigaciones, 2008 | 7 | 2008 |
Trees (Dendrograms and Consensus Trees) and their topological information G Restrepo, EJ Llanos, JL Villaveces Proceedings of the Fourth Indo-US Workshop on Mathematical Chamistry …, 2005 | 6 | 2005 |
Similarity in chemical reaction networks: Categories, concepts and closures A Bernal, E Llanos, W Leal, G Restrepo Advances in mathematical chemistry and applications, 24-54, 2015 | 5 | 2015 |
Chemical Elements: A Topological Approach G Restrepo, EJ Llanos, H Mesa International Conference of Computational Methods in Sciences and …, 2019 | 4 | 2019 |
Correction:'Exploration of the chemical space and its three historical regimes'[116 (2019) 26, 12660-12665] EJ Llanos, W Leal, HD Luu, J Jost, PF Stadler, G Restrepo Proceedings of the National Academy of Sciences of the United States of …, 2019 | 4 | 2019 |
A network model of the chemical space provides similarity structure to the system of chemical elements E Llanos, W Leal, A Bernal, G Restrepo, J Jost, P Stadler Complex networks 2019: the 8th international conference on complex networks …, 2019 | 4 | 2019 |
Topological study of the chemical elements G Restrepo, H Mesa, EJ Llanos, JL Villaveces Proceedings of Third Joint Sheffield Conference on Chemoinformatics, The …, 2004 | 4 | 2004 |
Computational approach to the history of chemical reactivity: Exploring Reaxys database E Llanos, W Leal, G Restrepo, P Stadler ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 254, 2017 | 3 | 2017 |
Lemont B. Kier: a bibliometric exploration of his scientific production and its use G Restrepo, E J Llanos, A E Silva Current Computer-Aided Drug Design 9 (4), 491-505, 2013 | 3 | 2013 |
Are the chemical families still there? Formal structure of similarity of elements and its thermochemical domain E Llanos, W Leal, A Bernal, J Jost, PF Stadler Proceedings A 480 (2298), 20240165, 2024 | | 2024 |