Yovani Marrero‐Ponce

Atom, atom-type and total molecular linear indices as a promising approach for bioorganic and medicinal chemistry: theoretical and experimental assessment of a novel method for virtual screening and rational design of new lead anthelmintic

Yovani Marrero‐Ponce, Juan A. Castillo‐Garit, Ervelio Olazábal et al. · Bioorganic & Medicinal Chemistry · 2004 · 96 citations

Combinatorial Chemistry, Medicinal Chemistry, Virtual Screening +14

Linear Indices of the “Molecular Pseudograph's Atom Adjacency Matrix”:  Definition, Significance-Interpretation, and Application to QSAR Analysis of Flavone Derivatives as HIV-1 Integrase Inhibitors

Yovani Marrero‐Ponce · Journal of Chemical Information and Computer Sciences · 2004 · 90 citations

Total and Local Quadratic Indices of the Molecular Pseudograph's Atom Adjacency Matrix: Applications to the Prediction of Physical Properties of Organic Compounds

Yovani Marrero‐Ponce · Molecules · 2003 · 87 citations · Full text

Engineering, Molecular Biology, Computational Chemistry +16

Ligand-Based Virtual Screening and in Silico Design of New Antimalarial Compounds Using Nonstochastic and Stochastic Total and Atom-Type Quadratic Maps

Yovani Marrero‐Ponce, Maité Iyarreta-Veitía, Alina Montero et al. · Journal of Chemical Information and Modeling · 2005 · 86 citations

3D-Chiral quadratic indices of the ‘molecular pseudograph’s atom adjacency matrix’ and their application to central chirality codification: classification of ACE inhibitors and prediction of σ-receptor antagonist activities

Yovani Marrero‐Ponce, Humberto González‐Díaz, Vicente Romero Zaldívar et al. · Bioorganic & Medicinal Chemistry · 2004 · 84 citations

Molecular Pharmacology, 3D-chiral Quadratic Indices, Ace Inhibitors +10