Thermodynamics

Intramolecular interaction energies in model alanine and glycine tetrapeptides. Evaluation of anisotropy, polarization, and correlation effects. A parallel ab initio HF/MP2, DFT, and polarizable molecular mechanics study

Thermodynamics / Computational Chemistry / Molecular Mechanics / Mathematical Computing / THEORETICAL AND COMPUTATIONAL CHEMISTRY / Molecular Conformation / Glycine / Alanine / Molecular Conformation / Glycine / Alanine

Empirical free energy calculation: Comparison to calorimetric data

Thermodynamics / Physical Chemistry / Protein Folding / Protein Science / Molecular Mechanics / Complex System / van der Waals interaction / Protein folding/unfolding / Proteins / Van Der Waals / Free Energy / Evaluation Model / Heat Capacity / Surface Area / Calorimetry / Biochemistry and cell biology / Binding free energy / Complex System / van der Waals interaction / Protein folding/unfolding / Proteins / Van Der Waals / Free Energy / Evaluation Model / Heat Capacity / Surface Area / Calorimetry / Biochemistry and cell biology / Binding free energy

DESARROLLO DE HERRAMIENTAS VIRTUALES PARA LA ENSEÑANZA DE LA TERMODINÁMICA BÁSICA

Thermodynamics / Man Machine Interface

Transfer coefficients for evaporation of a system with a Lennard-Jones long-range spline potential

Engineering / Thermodynamics / Heat and Mass Transfer / Kinetic Theory / Mathematical Sciences / Physical sciences / Long Range / Phase transition / Autonomic System / Molecular Dynamic Simulation / Physical sciences / Long Range / Phase transition / Autonomic System / Molecular Dynamic Simulation

Experimental and computational approaches to electrical conductor loading characteristics

Pharmacology / Thermodynamics / Physical Chemistry / Polymorphism / Protein Folding / Drug Discovery / Drug delivery / Rule of Law / Adsorption / Protein Design / Computers / Permeability / High throughput screening / Advanced Drug Delivery Research / Gene Network / Solubility / Free Energy / Protein Function / Biological Network / Biological systems / Molecular weight / Rule Based / Pharmaceutical preparations / Drug Discovery / Drug delivery / Rule of Law / Adsorption / Protein Design / Computers / Permeability / High throughput screening / Advanced Drug Delivery Research / Gene Network / Solubility / Free Energy / Protein Function / Biological Network / Biological systems / Molecular weight / Rule Based / Pharmaceutical preparations

Deriving amino acid contact potentials from their frequencies of occurrence in proteins: a lattice model study

Materials Engineering / Condensed Matter Physics / Thermodynamics / Nanotechnology / Lattice Beam Model / Amino Acid Profile / Frequency of occurrence / Amino Acid Profile / Frequency of occurrence

Mullite-refractory metal (Mo, Nb) composites

Materials Engineering / Thermodynamics / Fatigue crack growth / Particle Size / Microstructures / Wear resistance / Electric Conductivity / Volume Fraction / Wear resistance / Electric Conductivity / Volume Fraction

Atom–bond pairwise additive representation for intermolecular potential energy surfaces

Thermodynamics / Technology / Kinetics / Quantum Theory / Chemical Physics / Complex System / Computer Simulation / Physical sciences / Methane / The / CHEMICAL SCIENCES / Hydrogen Bonding / Validation Studies / Binding Energy / Halogens / Reproducibility of Results / Benzene / THEORETICAL AND COMPUTATIONAL CHEMISTRY / Molecular Conformation / Potential Energy Surface / Cations / Ab Initio Calculation / Force Field Analysis / Molecular Dynamic Simulation / Molecular Interactions / Perturbation Theory / Molecular Structure / Complex System / Computer Simulation / Physical sciences / Methane / The / CHEMICAL SCIENCES / Hydrogen Bonding / Validation Studies / Binding Energy / Halogens / Reproducibility of Results / Benzene / THEORETICAL AND COMPUTATIONAL CHEMISTRY / Molecular Conformation / Potential Energy Surface / Cations / Ab Initio Calculation / Force Field Analysis / Molecular Dynamic Simulation / Molecular Interactions / Perturbation Theory / Molecular Structure

Composite soy lecithin–decylpolyglucoside vesicles: A theoretical and experimental study

Engineering / Thermodynamics / Transmission Electron Microscopy / Drug Delivery System / Physical sciences / Experimental Study / CHEMICAL SCIENCES / Size Distribution / Photon Correlation Spectroscopy / Physicochemical Properties / Experimental Study / CHEMICAL SCIENCES / Size Distribution / Photon Correlation Spectroscopy / Physicochemical Properties

DESARROLLO DE HERRAMIENTAS VIRTUALES PARA LA ENSEÑANZA DE LA TERMODINÁMICA BÁSICA

Thermodynamics / Man Machine Interface

Preparation and characterization of Sm0.2Ce0.8O1.9/Na2CO3 nanocomposite electrolyte for low-temperature solid oxide fuel cells

Engineering / Thermodynamics / Performance / Stability / Fuel Cell / Nanocomposite / Hydrogen Energy / Methanol / Solid oxide fuel cell / Conductivity / Feasibility / CHEMICAL SCIENCES / Precipitation / Low Temperature / Long Term / Anode / Water Vapor / Peak Power / Open Circuit Voltage / Nanocomposite / Hydrogen Energy / Methanol / Solid oxide fuel cell / Conductivity / Feasibility / CHEMICAL SCIENCES / Precipitation / Low Temperature / Long Term / Anode / Water Vapor / Peak Power / Open Circuit Voltage

Evaluación comparativa de los modelos SAFT, Peng-Robinson y UNIFAC para reproducir datos experimentales de equilibrio liquido-vapor en sistemas binarios

Chemical Engineering / Thermodynamics / Equations of State / Cubic Equations of State / Ingenieria Quimica / Termodinamica

POLIMERIZACIÓN EN MICROEMULSIÓN: CONSTRUYENDO UN MODELO UTILIZANDO LA CONVERSIÓN EXPERIMENTAL Y SU DERIVADA MICROEMULSION POLYMERIZATION: BUILDING A MODEL USING THE EXPERIMENTAL CONVERSION AND ITS DERIVATIVE

Thermodynamics / Kinetics / Reaction Rate / PHENOMENOLOGICAL MODEL

Topographical complexity of multidimensional energy landscapes

Computer Graphics / Thermodynamics / Information Theory / Kinetics / Multidisciplinary / Proteins

ARTÍCULO TÉCNICO TRATAMIENTO DE AGUA PARA CALDERAS

Chemical Engineering / Thermodynamics / Energy / Transferencia de calor

INSTITUTO POLITÉCNICO NACIONAL ESCUELA SUPERIOR DE INGENIERÍA QUÍMICA E INDUSTRIAS EXTRACTIVAS Sección de Estudios de Posgrado e Investigación Maestría en Ciencias en Ingeniería Química Protocolo de tesis

Thermodynamics

«
1
2
3
4
5
6
7
8
9
10
11
12
»

Copyright © 2017 DATOSPDF Inc.