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OPTIMIZATION OF PHYSICO-CHEMICAL MODELS USING THE GAUSS-NEWTON METHOD
(Sociedad Chilena de Química, 2005)
Lessons learned about steered molecular dynamics simulations and free energy calculations
(Wiley Blackwell Publishing, Inc, 2019-01)
The calculation of free energy profiles is central in understanding differential enzymatic activity, for instance, involving chemical reactions that require QM-MM tools, ligand migration, and conformational rearrangements ...
Charting molecular free-energy landscapes with an atlas of collective variables
(American Institute of Physics, 2016-11)
Collective variables (CVs) are a fundamental tool to understand molecular flexibility, to compute free energy landscapes, and to enhance sampling in molecular dynamics simulations. However, identifying suitable CVs is ...
Desenvolvimento e a regulação do mercado livre de energia no Brasil
(Universidade Federal de Santa MariaBrasilEngenharia de ProduçãoUFSMPrograma de Pós-Graduação em Engenharia de ProduçãoCentro de Tecnologia, 2017-03-06)
The development of the Free Energy Market in Brazil gained considerable importance due to
a series of recent transformations in Brazilian politics. For a long time, investments were not
made in this sector, causing a ...
Statistical thermodynamics of liquids using the Monte Carlo method. II. Liquid chloroform.
(Soc Brasileira QuimicaSao PauloBrasil, 1999)
«Energy Regulatory Commission»: Character and functions after energy reformNaturaleza y funciones de la «Comisión Reguladora de Energía» tras la reforma energética
(Pontificia Universidad Católica del Perú, 2016)
Comparative studies of the nonlinear effects occurring when highly charged projectiles collide with hydrogen, a free electron gas, and a harmonic oscillator
(American Physical Society, 2005-12)
We calculate the nonlinear effects that appear at the level of the stopping cross section when heavy bare projectiles collide with both atomic hydrogen and a free electron gas. Calculations are carried out by using ...
Effect of free-choice feeding on the performance and ileal digestibility of nutrients in broilers
(Fundação APINCO de Ciência e Tecnologia Avícolas, 2005-09-01)
An experiment was conducted to study ileal digestibility of nutrients and to verify the ability of broilers to select feed in order to meet their requirements for protein and energy. The treatments consisted of six diets: ...
Effect of free-choice feeding on the performance and ileal digestibility of nutrients in broilers
(Fundação APINCO de Ciência e Tecnologia Avícolas, 2005-09-01)
An experiment was conducted to study ileal digestibility of nutrients and to verify the ability of broilers to select feed in order to meet their requirements for protein and energy. The treatments consisted of six diets: ...
Effect of the aspartic acid D2 on the affinity of Polybia-MP1 to anionic lipid vesicles
(Springer, 2014-05-01)
Polybia-MP1 (IDWKKLLDAAKQIL-NH2), a helical peptide extracted from the venom of a Brazilian wasp, has broad-spectrum antimicrobial activities without being hemolytic or cytotoxic. This peptide has also displayed anticancer ...