| Medium chain fatty acids are selective peroxisome proliferator activated receptor (PPAR) γ activators and pan-PPAR partial agonists MV Liberato, AS Nascimento, SD Ayers, JZ Lin, A Cvoro, RL Silveira, ... PloS one 7 (5), e36297, 2012 | 131 | 2012 |
| Computational modeling of realistic cell membranes SJ Marrink, V Corradi, PCT Souza, HI Ingólfsson, DP Tieleman, ... Chemical reviews 119 (9), 6184-6226, 2019 | 111 | 2019 |
| GQ-16, a novel peroxisome proliferator-activated receptor γ (PPARγ) ligand, promotes insulin sensitization without weight gain AA Amato, S Rajagopalan, JZ Lin, BM Carvalho, ACM Figueira, J Lu, ... Journal of Biological Chemistry 287 (33), 28169-28179, 2012 | 92 | 2012 |
| Molecular mechanism of peroxisome proliferator-activated receptor α activation by WY14643: a new mode of ligand recognition and receptor stabilization A Bernardes, PCT Souza, JRC Muniz, CG Ricci, SD Ayers, NM Parekh, ... Journal of molecular biology 425 (16), 2878-2893, 2013 | 79 | 2013 |
| Enhancing Molecular n‐Type Doping of Donor–Acceptor Copolymers by Tailoring Side Chains J Liu, L Qiu, R Alessandri, X Qiu, G Portale, JJ Dong, W Talsma, G Ye, ... Advanced Materials 30 (7), 1704630, 2018 | 72 | 2018 |
| CHARMM‐GUI Martini Maker for modeling and simulation of complex bacterial membranes with lipopolysaccharides PC Hsu, BMH Bruininks, D Jefferies, P Cesar Telles de Souza, J Lee, ... Journal of computational chemistry 38 (27), 2354-2363, 2017 | 48 | 2017 |
| Analysis of agonist and antagonist effects on thyroid hormone receptor conformation by hydrogen/deuterium exchange ACM Figueira, DM Saidemberg, PCT Souza, L Martínez, TS Scanlan, ... Molecular Endocrinology 25 (1), 15-31, 2011 | 47 | 2011 |
| Identification of a new hormone-binding site on the surface of thyroid hormone receptor PCT Souza, AC Puhl, L Martínez, R Aparício, AS Nascimento, ... Molecular Endocrinology 28 (4), 534-545, 2014 | 33 | 2014 |
| Pitfalls of the Martini Model R Alessandri, PCT Souza, S Thallmair, MN Melo, AH de Vries, SJ Marrink Journal of Chemical Theory and Computation 15 (10), 5448-5460, 2019 | 25 | 2019 |
| Isomeric separation of cannabinoids by UPLC combined with ionic mobility mass spectrometry (TWIM-MS)—Part I LV Tose, NA Santos, RRT Rodrigues, M Murgu, AF Gomes, ... International Journal of Mass Spectrometry 418, 112-121, 2017 | 19 | 2017 |
| Helix 12 dynamics and thyroid hormone receptor activity: experimental and molecular dynamics studies of Ile280 mutants PCT Souza, GB Barra, LFR Velasco, ICJ Ribeiro, LA Simeoni, M Togashi, ... Journal of molecular biology 412 (5), 882-893, 2011 | 19 | 2011 |
| CHARMM force field parameterization of rosiglitazone A Hansson, PCT Souza, RL Silveira, L Martínez, MS Skaf International Journal of Quantum Chemistry 111 (7‐8), 1346-1354, 2011 | 16 | 2011 |
| High performance collision cross section calculation—HPCCS L Zanotto, G Heerdt, PCT Souza, G Araujo, MS Skaf Journal of computational chemistry 39 (21), 1675-1681, 2018 | 14 | 2018 |
| CHARMM‐based parameterization of neutral articaine—A widely used local anesthetic ÉT Prates, PCT Souza, M Pickholz, MS Skaf International Journal of Quantum Chemistry 111 (7‐8), 1339-1345, 2011 | 14 | 2011 |
| An alternative conformation of ERβ bound to estradiol reveals H12 in a stable antagonist position PCT Souza, LC Textor, DC Melo, AS Nascimento, MS Skaf, I Polikarpov Scientific reports 7 (1), 1-11, 2017 | 11 | 2017 |
| Molecular recognition of PPARγ by kinase CDK5/p25: Insights from a combination of protein–protein docking and adaptive biasing force simulations M Mottin, PCT Souza, MS Skaf The Journal of Physical Chemistry B 119 (26), 8330-8339, 2015 | 10 | 2015 |
| A practical view of the Martini force field BMH Bruininks, PCT Souza, SJ Marrink Biomolecular Simulations, 105-127, 2019 | 9 | 2019 |
| On the denaturation mechanisms of the ligand binding domain of thyroid hormone receptors L Martínez, PCT Souza, W Garcia, FAH Batista, RV Portugal, ... The Journal of Physical Chemistry B 114 (3), 1529-1540, 2010 | 6 | 2010 |
| Membrane mediated toppling mechanism of the folate energy coupling factor transporter I Faustino, H Abdizadeh, PCT Souza, A Jeucken, WK Stanek, A Guskov, ... Nature communications 11 (1), 1-9, 2020 | 1 | 2020 |
| An Allosteric Pathway in Copper, Zinc Superoxide Dismutase Unravels the Molecular Mechanism of the G93A Amyotrophic Lateral Sclerosis-Linked Mutation PCT Souza, S Thallmair, SJ Marrink, R Mera-Adasme The journal of physical chemistry letters 10 (24), 7740-7744, 2019 | 1 | 2019 |
Munir S. SkafInstitute of Chemistry, University of Campinas - UNICAMPVerified email at iqm.unicamp.br
