Using Molecular Dynamics simulations and Quantum Mechanical calculations, we study the behavior of molecules with biophysical and pharmacological interest in solution and in phospholipid bilayer.FAPESPCNPqINCT-FCxCAPESNBioNet / CAPE
An ion pair amphiphile (IPA), a molecular complex composed of two oppositely charged amphiphiles, is...
Phosphatidic acids (PAs) have many biological functions in biomembranes, e.g., they are involved in ...
AbstractWe performed a molecular dynamics simulation of dipalmitoylphosphatidylserine (DPPS) bilayer...
Using Molecular Dynamics simulations and Quantum Mechanical calculations, we study the behavior of m...
Solvent effects are of essential importance in many different aspects of\ud physics, chemistry, biol...
AbstractFluorescence methods are widely used in studies of biological and model membranes. The dynam...
Fluorescence spectroscopy and microscopy have been used as tools to study membrane biophysics for de...
In the first part of the thesis, the molecular structure and electronic properties of phospholipids ...
We present the results of molecular dynamics (MD) simulations of a phospholipid membrane in water, i...
We have performed molecular dynamics simulations of lipid bilayers composed of inverse-phosphatidylc...
Properties of phospholipid membrane bilayers and of proteins associating and functioning in the memb...
Tese de doutoramento, Bioquímica (Bioquímica Teórica), Universidade de Lisboa, Faculdade de Ciências...
Nucleolipids are currently under investigation as vectors for oligonucleotides (ON) delivery thanks ...
In this paper we report on the molecular dynamics simulation of a fluid phase hydrated dimyristoylph...
The partitioning behavior of drug-like molecules into biomembranes has a crucial impact on the desig...
An ion pair amphiphile (IPA), a molecular complex composed of two oppositely charged amphiphiles, is...
Phosphatidic acids (PAs) have many biological functions in biomembranes, e.g., they are involved in ...
AbstractWe performed a molecular dynamics simulation of dipalmitoylphosphatidylserine (DPPS) bilayer...
Using Molecular Dynamics simulations and Quantum Mechanical calculations, we study the behavior of m...
Solvent effects are of essential importance in many different aspects of\ud physics, chemistry, biol...
AbstractFluorescence methods are widely used in studies of biological and model membranes. The dynam...
Fluorescence spectroscopy and microscopy have been used as tools to study membrane biophysics for de...
In the first part of the thesis, the molecular structure and electronic properties of phospholipids ...
We present the results of molecular dynamics (MD) simulations of a phospholipid membrane in water, i...
We have performed molecular dynamics simulations of lipid bilayers composed of inverse-phosphatidylc...
Properties of phospholipid membrane bilayers and of proteins associating and functioning in the memb...
Tese de doutoramento, Bioquímica (Bioquímica Teórica), Universidade de Lisboa, Faculdade de Ciências...
Nucleolipids are currently under investigation as vectors for oligonucleotides (ON) delivery thanks ...
In this paper we report on the molecular dynamics simulation of a fluid phase hydrated dimyristoylph...
The partitioning behavior of drug-like molecules into biomembranes has a crucial impact on the desig...
An ion pair amphiphile (IPA), a molecular complex composed of two oppositely charged amphiphiles, is...
Phosphatidic acids (PAs) have many biological functions in biomembranes, e.g., they are involved in ...
AbstractWe performed a molecular dynamics simulation of dipalmitoylphosphatidylserine (DPPS) bilayer...