Paulo Cesar Telles de Souza
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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
Computational modeling of realistic cell membranes
SJ Marrink, V Corradi, PCT Souza, HI Ingólfsson, DP Tieleman, ...
Chemical reviews 119 (9), 6184-6226, 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
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
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
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
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
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
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
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
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
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
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
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
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
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
A practical view of the Martini force field
BMH Bruininks, PCT Souza, SJ Marrink
Biomolecular Simulations, 105-127, 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
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
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
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