MAP kinases and the control of nuclear events AG Turjanski, JP Vaque, JS Gutkind Oncogene 26 (22), 3240-3253, 2007 | 548 | 2007 |
Binding-induced folding of a natively unstructured transcription factor AG Turjanski, JS Gutkind, RB Best, G Hummer PLoS computational biology 4 (4), e1000060, 2008 | 231 | 2008 |
Protein frustratometer: a tool to localize energetic frustration in protein molecules M Jenik, RG Parra, LG Radusky, A Turjanski, PG Wolynes, DU Ferreiro Nucleic acids research 40 (W1), W348-W351, 2012 | 169 | 2012 |
Aromatic–aromatic interactions in proteins: beyond the dimer E Lanzarotti, RR Biekofsky, DA Estrin, MA Marti, AG Turjanski Journal of chemical information and modeling 51 (7), 1623-1633, 2011 | 143 | 2011 |
Scavenging of NO by melatonin AG Turjanski, F Leonik, DA Estrin, RE Rosenstein, F Doctorovich Journal of the American Chemical Society 122 (42), 10468-10469, 2000 | 102 | 2000 |
Reactions of melatonin and related indoles with free radicals: a computational study AG Turjanski, RE Rosenstein, DA Estrin Journal of medicinal chemistry 41 (19), 3684-3689, 1998 | 98 | 1998 |
Molecular dynamics in mixed solvents reveals protein–ligand interactions, improves docking, and allows accurate binding free energy predictions JP Arcon, LA Defelipe, CP Modenutti, ED López, D Alvarez-Garcia, ... Journal of chemical information and modeling 57 (4), 846-863, 2017 | 95 | 2017 |
Preclinical development of novel Rac1-GEF signaling inhibitors using a rational design approach in highly aggressive breast cancer cell lines G A Cardama, M J Comin, L Hornos, N Gonzalez, L Defelipe, ... Anti-Cancer Agents in Medicinal Chemistry (Formerly Current Medicinal …, 2014 | 86 | 2014 |
Physiological concentrations of melatonin inhibit the nitridergic pathway in the Syrian hamster retina DA Sáenz, AG Turjanski, GB Sacca, M Marti, F Doctorovich, ... Journal of pineal research 33 (1), 31-36, 2002 | 70 | 2002 |
Molecular and functional characterization of a juvenile hormone acid methyltransferase expressed in the corpora allata of mosquitoes JG Mayoral, M Nouzova, M Yoshiyama, T Shinoda, ... Insect biochemistry and molecular biology 39 (1), 31-37, 2009 | 66 | 2009 |
Whole Genome Sequencing Reveals a De Novo SHANK3 Mutation in Familial Autism Spectrum Disorder SI Nemirovsky, M Córdoba, JJ Zaiat, SP Completa, PA Vega, ... PloS one 10 (2), e0116358, 2015 | 63 | 2015 |
Exploration and optimization of substituted triazolothiadiazines and triazolopyridazines as PDE4 inhibitors AP Skoumbourdis, CA LeClair, E Stefan, AG Turjanski, W Maguire, ... Bioorganic & medicinal chemistry letters 19 (13), 3686-3692, 2009 | 63 | 2009 |
NMR and molecular dynamics studies of the interaction of melatonin with calmodulin AG Turjanski, DA Estrin, RE Rosenstein, JE McCormick, SR Martin, ... Protein Science 13 (11), 2925-2938, 2004 | 61 | 2004 |
WATCLUST: a tool for improving the design of drugs based on protein-water interactions ED Lopez, JP Arcon, DF Gauto, AA Petruk, CP Modenutti, VG Dumas, ... Bioinformatics 31 (22), 3697-3699, 2015 | 59 | 2015 |
Target-Pathogen: a structural bioinformatic approach to prioritize drug targets in pathogens EJ Sosa, G Burguener, E Lanzarotti, L Defelipe, L Radusky, AM Pardo, ... Nucleic acids research 46 (D1), D413-D418, 2018 | 58 | 2018 |
Nitrosation of melatonin by nitric oxide: a computational study AG Turjanski, DA Sáenz, F Doctorovich, DA Estrin, RE Rosenstein Journal of pineal research 31 (2), 97-101, 2001 | 57 | 2001 |
How mitogen-activated protein kinases recognize and phosphorylate their targets: A QM/MM study AG Turjanski, G Hummer, JS Gutkind Journal of the American Chemical Society 131 (17), 6141-6148, 2009 | 55 | 2009 |
AutoDock Bias: improving binding mode prediction and virtual screening using known protein–ligand interactions JP Arcon, CP Modenutti, D Avendaño, ED Lopez, LA Defelipe, ... Bioinformatics 35 (19), 3836-3838, 2019 | 53 | 2019 |
Toward unrestricted use of public genomic data RI Amann, S Baichoo, BJ Blencowe, P Bork, M Borodovsky, ... Science 363 (6425), 350-352, 2019 | 53 | 2019 |
Juvenile hormone synthesis:“esterify then epoxidize” or “epoxidize then esterify”? Insights from the structural characterization of juvenile hormone acid methyltransferase LA Defelipe, E Dolghih, AE Roitberg, M Nouzova, JG Mayoral, ... Insect Biochemistry and Molecular Biology 41 (4), 228-235, 2011 | 53 | 2011 |