MOLECULAR-DYNAMICS

Label

• MOLECULAR-DYNAMICS (literal)

Membro di

• Parole chiave di "First-Principles Study of Water Ice Adsorption on the Methyl-Terminated Si(111) Surface" (Insieme di parole chiave)
• Parole chiave di "Characterization of laser ablation of solid targets with near-infrared laser pulses of 100 fs and 1 ps duration" (Insieme di parole chiave)
• Keywords of "VARICELLA: a variable-cell direct space method for structure determination from powder diffraction data" (Insieme di parole chiave)
• Keywords of "MEMBPLUGIN: studying membrane complexity in VMD" (Insieme di parole chiave)
• Keywords of "Defect-induced homogeneous amorphization of silicon: the role of defect structure and population" (Insieme di parole chiave)
• Keywords of "Interaction of zwitterionic penicillins with the OmpF channel facilitates their translocation" (Insieme di parole chiave)
• Parole chiave di "Large-scale motions and electrostatic properties of furin and HIV-1 protease" (Insieme di parole chiave)
• Keywords of "Interaction between the DNA model base 9-ethylguanine and a group of ruthenium polypyridyl complexes: Kinetics and conformational temperature dependence" (Insieme di parole chiave)
• Parole chiave di "Velocity plateaus and jumps in carbon nanotube sliding" (Insieme di parole chiave)
• Keywords of "Spinodal of supercooled polarizable water" (Insieme di parole chiave)
• Parole chiave di "Analyzing pathogenic mutations of C5 domain from cardiac myosin binding protein C through MD simulations" (Insieme di parole chiave)
• Parole chiave di "The Conformations of Amino Acids on a Gold(111) Surface" (Insieme di parole chiave)
• Parole chiave di "Dipolar correlations and the dielectric permittivity of water" (Insieme di parole chiave)
• Parole chiave di "Microseconds dynamics simulations of the outer-membrane protease T" (Insieme di parole chiave)
• Parole chiave di "Dynamical heterogeneities: from glasses to gels" (Insieme di parole chiave)
• Keywords of "Non-ergodicity in a locally ordered fragile glass former" (Insieme di parole chiave)
• Keywords of "Conformational Dynamics of Hyaluronan in Solution. 2. Mode-Coupling Diffusion Approach to Oligomers" (Insieme di parole chiave)
• Keywords of "Effect of temperature and pressure on the structural (alpha-) and the true Johari-Goldstein (beta-) relaxation in binary mixtures" (Insieme di parole chiave)
• Keywords of "First-principles study of density, viscosity, and diffusion coefficients of liquid MgSiO3 at conditions of the Earth's deep mantle" (Insieme di parole chiave)
• Keywords of "Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa" (Insieme di parole chiave)
• Keywords of "Acidification of three-dimensional emeraldine polymers: Search for minimum energy paths from base to salt" (Insieme di parole chiave)
• Parole chiave di "Structural, dynamical and functional aspects of the inner motions in the blue copper protein azurin" (Insieme di parole chiave)
• Parole chiave di "Geometry and electronic band structure of surfaces: the case of Ge(111): Sn and C(111)" (Insieme di parole chiave)
• Parole chiave di "Probing the cooperative dynamics varying the side-chain length of poly(alkyl acrylate)s: ESR experiments" (Insieme di parole chiave)
• Parole chiave di "Initial oxidation of the Rh(110) surface: Ordered adsorption and surface oxide structures" (Insieme di parole chiave)
• Keywords of "Vibrational properties of inclusion complexes: The case of indomethacin-cyclodextrin" (Insieme di parole chiave)
• Keywords of "Pressure-induced core packing and interfacial dehydration in nonionic C12E6 micelle in aqueous solution" (Insieme di parole chiave)
• Keywords of "Trial wave functions for high-pressure metallic hydrogen" (Insieme di parole chiave)
• Parole chiave di "Defects in ordered aggregates of cardiolipin visualized by atomic force microscopy" (Insieme di parole chiave)
• Keywords of "Excluded-volume corrections to the single-chain static properties of a polymer melt: Temperature, density and potential effects" (Insieme di parole chiave)
• Keywords of "Accurate excluded-volume corrections to the single-chain static properties of a melt of unentangled polymers" (Insieme di parole chiave)
• Keywords of "Binding of phosphinate and phosphonate inhibitors to aspartic proteases: A first-principles study" (Insieme di parole chiave)
• Parole chiave di "The influence of macromolecular crowding on HIV-1 protease internal dynamics" (Insieme di parole chiave)
• Keywords of "Wrapped-around Models for the Lac Operon Complex" (Insieme di parole chiave)
• Parole chiave di "Water-mediated electron transfer between protein redox centers" (Insieme di parole chiave)
• Parole chiave di "Phase diagram of nuclear 'pasta' and its uncertainties in supernova cores" (Insieme di parole chiave)
• Keywords of "Using metadynamics to understand the mechanism of calmodulin/target recognition at atomic detail" (Insieme di parole chiave)
• Parole chiave di "Hydrodynamic correlations in the translocation of a biopolymer through a nanopore: Theory and multiscale simulations" (Insieme di parole chiave)
• Parole chiave di "Essential dynamics of helices provide a functional classification of EF-hand proteins" (Insieme di parole chiave)
• Parole chiave di "Silica through the eyes of colloidal models--when glass is a gel" (Insieme di parole chiave)
• Keywords of "Structure and dynamics of hydrogen bonds in the interface of a C12E6 spherical micelle in water solution: A MD study at various temperatures" (Insieme di parole chiave)
• Parole chiave di "Structure and energetics of diphenylalanine self-assembling on Cu(110)" (Insieme di parole chiave)
• Keywords of "Transport properties of chaotic and non-chaotic many particle systems" (Insieme di parole chiave)
• Keywords of "Ligand binding to truncated hemoglobin N from Mycobacterium tuberculosis is strongly modulated by the interplay between the distal heme pocket residues and internal water" (Insieme di parole chiave)
• Keywords of "Charged chromophoric units in protonated rare-gas clusters: A dynamical simulation" (Insieme di parole chiave)
• Keywords of "Optical properties of ZnO nanostructures: a hybrid DFT/TDDFT investigation" (Insieme di parole chiave)
• Parole chiave di "Preferential hydration of lysozyme in water/glycerol mixtures: A small-angle neutron scattering study" (Insieme di parole chiave)
• Keywords of "Conformational adaptation in supramolecular assembly on surfaces" (Insieme di parole chiave)
• Keywords of "Atomistic modeling of brittleness in covalent materials" (Insieme di parole chiave)
• Parole chiave di "Structural and dynamical alignment of enzymes with partial structural similarity" (Insieme di parole chiave)
• Parole chiave di "On the oligomeric state of DJ-1 protein and its mutants associated with Parkinson disease - A combined computational and in vitro study" (Insieme di parole chiave)
• Keywords of "CO escape from myoglobin with metadynamics simulations" (Insieme di parole chiave)
• Parole chiave di "Electrical conductivity of warm expanded Al" (Insieme di parole chiave)
• Keywords of "String method in collective variables: Minimum free energy paths and isocommittor surfaces" (Insieme di parole chiave)
• Parole chiave di "Aging in a Laponite colloidal suspension: A Brownian dynamics simulation study" (Insieme di parole chiave)
• Keywords of "Testing simplified proteins models of the hPin1 WW domain" (Insieme di parole chiave)
• Parole chiave di "Structural determinants of ligand migration in Mycobacterium tuberculosis truncated hemoglobin O" (Insieme di parole chiave)
• Parole chiave di "Atomic scale simulations of vapor cooled carbon clusters" (Insieme di parole chiave)
• Parole chiave di "Chain dynamics in nonentangled polymer melts: A first-principle approach for the role of intramolecular barriers" (Insieme di parole chiave)
• Parole chiave di "Flap opening dynamics in HIV-1 protease explored with a coarse-grained model" (Insieme di parole chiave)
• Keywords of "Comment on 'Decrease in the configurational entropy during a melt's polymerization' [Chem. Phys. 305 (2004) 231]" (Insieme di parole chiave)
• Parole chiave di "Dynamical heterogeneity in a model for permanent gels: Different behavior of dynamical susceptibilities" (Insieme di parole chiave)
• Parole chiave di "Femtosecond laser ablation of nickel in vacuum" (Insieme di parole chiave)
• Parole chiave di "Self-assembling DNA dendrimers: A numerical study" (Insieme di parole chiave)
• Keywords of "Understanding fragility in supercooled Lennard-Jones mixtures. II. Potential energy surface" (Insieme di parole chiave)
• Parole chiave di "Dynamics of water confined in fuel cell Nafion membranes containing zirconium phosphate nanofiller" (Insieme di parole chiave)
• Keywords of "Modeling the Backbone Dynamics of reduced and Oxidized Solvated Rat Microsomal Cytochrome b5" (Insieme di parole chiave)
• Keywords of "A computational study of elastic properties of disordered systems with voids" (Insieme di parole chiave)
• Parole chiave di "Carbonic anhydrase inhibitors: hypoxia-activatable sulfonamides incorporating disulfide bonds that target the tumor-associated isoform IX" (Insieme di parole chiave)
• Keywords of "Controlling the protein dynamical transition with sugar-based bioprotectant matrices: A neutron scattering study" (Insieme di parole chiave)
• Keywords of "Formumation of improved basis sets for the study of polymer dynamics through diffusion theory methods" (Insieme di parole chiave)
• Parole chiave di "Ozone-based atomic layer deposition of alumina from TMA: Growth, morphology, and reaction mechanism" (Insieme di parole chiave)
• Keywords of "Pressure effect on water dynamics in tert-butyl alcohol/water solutions" (Insieme di parole chiave)
• Keywords of "Design of quasisymplectic propagators for Langevin dynamics" (Insieme di parole chiave)
• Parole chiave di "Freezing of gold nanoclusters into poly-decahedral structures" (Insieme di parole chiave)
• Parole chiave di "Convergent dynamics in the protease enzymatic superfamily" (Insieme di parole chiave)
• Keywords of "Computational analysis of folding and mutation properties of C5 domain from Myosin Binding Protein C" (Insieme di parole chiave)
• Keywords of "Temperature-dependent dynamics of water confined in Nafion membranes" (Insieme di parole chiave)
• Parole chiave di "Vibrational dynamics of inclusion complexes by Raman scattering: an experimental and numerical study" (Insieme di parole chiave)
• Parole chiave di "Trends in biomedical engineering: focus on Smart Bio-Materials and Drug Delivery" (Insieme di parole chiave)
• Keywords of "Structure and dynamics of small protonated rare-gas clusters using quantum and classical methods" (Insieme di parole chiave)
• Parole chiave di "ATP binding to the C-terminus of the Arabidopsis thaliana, AtCLCa, regulates nitrate transport into plant vacuoles." (Insieme di parole chiave)
• Parole chiave di "Correspondences between low-energy modes in enzymes: Dynamics-based alignment of enzymatic functional families" (Insieme di parole chiave)
• Parole chiave di "Density functional theory study of formic acid adsorption on anatase TiO2(001): Geometries, energetics, and effects of coverage, hydration, and reconstruction" (Insieme di parole chiave)
• Keywords of "High frequency collective dynamics in liquid potassium" (Insieme di parole chiave)
• Keywords of "Numerical integration of projective Hamiltonian dynamics" (Insieme di parole chiave)
• Parole chiave di "Etectronic coupling between azurin and gold at different protein/substrate orientations" (Insieme di parole chiave)
• Keywords of "Density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials: Application to fcc-Pt and fcc-Au" (Insieme di parole chiave)
• Parole chiave di "Trotter-based simulation of quantum-classical dynamics" (Insieme di parole chiave)
• Keywords of "The impact of kosmotropes and chaotropes on bulk and hydration shell water dynamics in a model peptide solution" (Insieme di parole chiave)
• Parole chiave di "The combined effects of temperature and polymerization rate changes on the real-time conduction and relaxation of a liquid, and the evolution of localized motions" (Insieme di parole chiave)
• Keywords of "Inferring the effective thickness of polyelectrolytes from stretching measurements at various ionic strengths: applications to DNA and RNA" (Insieme di parole chiave)
• Parole chiave di "Structure and function of vanadium haloperoxidases" (Insieme di parole chiave)
• Parole chiave di "Two distinct heme distal site states define Cerebratulus lacteus mini-hemoglobin oxygen affinity" (Insieme di parole chiave)
• Parole chiave di "Mass flux through asymmetric nanopores: Microscopic versus hydrodynamic motion" (Insieme di parole chiave)
• Keywords of "Anomalous Wetting Layer at the Au(111) Surface" (Insieme di parole chiave)
• Keywords of "Stability and dynamics of the porcine odorant-binding protein" (Insieme di parole chiave)
• Keywords of "Anharmonicity and self-similarity of the free energy landscape of protein G" (Insieme di parole chiave)
• Keywords of "Water confined in nanopores: Spontaneous formation of microcavities" (Insieme di parole chiave)
• Parole chiave di "Role of dipolar correlations in the infrared spectra of water and ice" (Insieme di parole chiave)
• Keywords of "Structural characterization of Ni2Si pseudoepitaxial transrotational structures on [001] Si" (Insieme di parole chiave)
• Keywords of "Computational analysis of current and noise properties of a single open ion channel" (Insieme di parole chiave)
• Keywords of "Stability and kinetic properties of C5-domain from myosin binding protein C and its mutants" (Insieme di parole chiave)
• Keywords of "Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst" (Insieme di parole chiave)
• Parole chiave di "Ligand-induced dynamical regulation of NO conversion in Mycobacterium tuberculosis truncated hemoglobin-N" (Insieme di parole chiave)
• Keywords of "Ab initio exploration of rearrangement reactions: intramolecular hydrogen scrambling processes in acetone" (Insieme di parole chiave)
• Parole chiave di "Heme Proteins: The Role of Solvent in the Dynamics of Gates and Portals" (Insieme di parole chiave)

Value

• MOLECULAR-DYNAMICS (literal)

Incoming links:

Ha membro

• Keywords of "Inferring the effective thickness of polyelectrolytes from stretching measurements at various ionic strengths: applications to DNA and RNA" (Insieme di parole chiave)
• Parole chiave di "Structure and energetics of diphenylalanine self-assembling on Cu(110)" (Insieme di parole chiave)
• Keywords of "Conformational adaptation in supramolecular assembly on surfaces" (Insieme di parole chiave)
• Parole chiave di "Trotter-based simulation of quantum-classical dynamics" (Insieme di parole chiave)
• Keywords of "Using metadynamics to understand the mechanism of calmodulin/target recognition at atomic detail" (Insieme di parole chiave)
• Parole chiave di "Flap opening dynamics in HIV-1 protease explored with a coarse-grained model" (Insieme di parole chiave)
• Parole chiave di "Phase diagram of nuclear 'pasta' and its uncertainties in supernova cores" (Insieme di parole chiave)
• Keywords of "Non-ergodicity in a locally ordered fragile glass former" (Insieme di parole chiave)
• Parole chiave di "Geometry and electronic band structure of surfaces: the case of Ge(111): Sn and C(111)" (Insieme di parole chiave)
• Parole chiave di "Mass flux through asymmetric nanopores: Microscopic versus hydrodynamic motion" (Insieme di parole chiave)
• Parole chiave di "Ligand-induced dynamical regulation of NO conversion in Mycobacterium tuberculosis truncated hemoglobin-N" (Insieme di parole chiave)
• Parole chiave di "Chain dynamics in nonentangled polymer melts: A first-principle approach for the role of intramolecular barriers" (Insieme di parole chiave)
• Keywords of "Pressure-induced core packing and interfacial dehydration in nonionic C12E6 micelle in aqueous solution" (Insieme di parole chiave)
• Keywords of "Accurate excluded-volume corrections to the single-chain static properties of a melt of unentangled polymers" (Insieme di parole chiave)
• Parole chiave di "Hydrodynamic correlations in the translocation of a biopolymer through a nanopore: Theory and multiscale simulations" (Insieme di parole chiave)
• Parole chiave di "The influence of macromolecular crowding on HIV-1 protease internal dynamics" (Insieme di parole chiave)
• Keywords of "A computational study of elastic properties of disordered systems with voids" (Insieme di parole chiave)
• Keywords of "Vibrational properties of inclusion complexes: The case of indomethacin-cyclodextrin" (Insieme di parole chiave)
• Keywords of "Interaction of zwitterionic penicillins with the OmpF channel facilitates their translocation" (Insieme di parole chiave)
• Parole chiave di "On the oligomeric state of DJ-1 protein and its mutants associated with Parkinson disease - A combined computational and in vitro study" (Insieme di parole chiave)
• Parole chiave di "Dynamical heterogeneity in a model for permanent gels: Different behavior of dynamical susceptibilities" (Insieme di parole chiave)
• Parole chiave di "Dynamics of water confined in fuel cell Nafion membranes containing zirconium phosphate nanofiller" (Insieme di parole chiave)
• Parole chiave di "Dynamical heterogeneities: from glasses to gels" (Insieme di parole chiave)
• Keywords of "Structure and dynamics of hydrogen bonds in the interface of a C12E6 spherical micelle in water solution: A MD study at various temperatures" (Insieme di parole chiave)
• Parole chiave di "Ozone-based atomic layer deposition of alumina from TMA: Growth, morphology, and reaction mechanism" (Insieme di parole chiave)
• Parole chiave di "Essential dynamics of helices provide a functional classification of EF-hand proteins" (Insieme di parole chiave)
• Parole chiave di "Femtosecond laser ablation of nickel in vacuum" (Insieme di parole chiave)
• Keywords of "Anharmonicity and self-similarity of the free energy landscape of protein G" (Insieme di parole chiave)
• Keywords of "Design of quasisymplectic propagators for Langevin dynamics" (Insieme di parole chiave)
• Keywords of "Density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials: Application to fcc-Pt and fcc-Au" (Insieme di parole chiave)
• Keywords of "Numerical integration of projective Hamiltonian dynamics" (Insieme di parole chiave)
• Keywords of "First-principles study of density, viscosity, and diffusion coefficients of liquid MgSiO3 at conditions of the Earth's deep mantle" (Insieme di parole chiave)
• Keywords of "Stability and kinetic properties of C5-domain from myosin binding protein C and its mutants" (Insieme di parole chiave)
• Parole chiave di "Structural and dynamical alignment of enzymes with partial structural similarity" (Insieme di parole chiave)
• Keywords of "Water confined in nanopores: Spontaneous formation of microcavities" (Insieme di parole chiave)
• Parole chiave di "Large-scale motions and electrostatic properties of furin and HIV-1 protease" (Insieme di parole chiave)
• Parole chiave di "Trends in biomedical engineering: focus on Smart Bio-Materials and Drug Delivery" (Insieme di parole chiave)
• Parole chiave di "ATP binding to the C-terminus of the Arabidopsis thaliana, AtCLCa, regulates nitrate transport into plant vacuoles." (Insieme di parole chiave)
• Keywords of "Structure and dynamics of small protonated rare-gas clusters using quantum and classical methods" (Insieme di parole chiave)
• Keywords of "Testing simplified proteins models of the hPin1 WW domain" (Insieme di parole chiave)
• Parole chiave di "Correspondences between low-energy modes in enzymes: Dynamics-based alignment of enzymatic functional families" (Insieme di parole chiave)
• Keywords of "Modeling the Backbone Dynamics of reduced and Oxidized Solvated Rat Microsomal Cytochrome b5" (Insieme di parole chiave)
• Parole chiave di "Freezing of gold nanoclusters into poly-decahedral structures" (Insieme di parole chiave)
• Parole chiave di "Characterization of laser ablation of solid targets with near-infrared laser pulses of 100 fs and 1 ps duration" (Insieme di parole chiave)
• Keywords of "Defect-induced homogeneous amorphization of silicon: the role of defect structure and population" (Insieme di parole chiave)
• Keywords of "Trial wave functions for high-pressure metallic hydrogen" (Insieme di parole chiave)
• Keywords of "Transport properties of chaotic and non-chaotic many particle systems" (Insieme di parole chiave)
• Keywords of "High frequency collective dynamics in liquid potassium" (Insieme di parole chiave)
• Keywords of "Ligand binding to truncated hemoglobin N from Mycobacterium tuberculosis is strongly modulated by the interplay between the distal heme pocket residues and internal water" (Insieme di parole chiave)
• Parole chiave di "Etectronic coupling between azurin and gold at different protein/substrate orientations" (Insieme di parole chiave)
• Parole chiave di "Initial oxidation of the Rh(110) surface: Ordered adsorption and surface oxide structures" (Insieme di parole chiave)
• Parole chiave di "Carbonic anhydrase inhibitors: hypoxia-activatable sulfonamides incorporating disulfide bonds that target the tumor-associated isoform IX" (Insieme di parole chiave)
• Parole chiave di "Microseconds dynamics simulations of the outer-membrane protease T" (Insieme di parole chiave)
• Parole chiave di "Structural determinants of ligand migration in Mycobacterium tuberculosis truncated hemoglobin O" (Insieme di parole chiave)
• Parole chiave di "Defects in ordered aggregates of cardiolipin visualized by atomic force microscopy" (Insieme di parole chiave)
• Parole chiave di "Water-mediated electron transfer between protein redox centers" (Insieme di parole chiave)
• Parole chiave di "Preferential hydration of lysozyme in water/glycerol mixtures: A small-angle neutron scattering study" (Insieme di parole chiave)
• Keywords of "The impact of kosmotropes and chaotropes on bulk and hydration shell water dynamics in a model peptide solution" (Insieme di parole chiave)
• Parole chiave di "Vibrational dynamics of inclusion complexes by Raman scattering: an experimental and numerical study" (Insieme di parole chiave)
• Parole chiave di "Convergent dynamics in the protease enzymatic superfamily" (Insieme di parole chiave)
• Keywords of "Conformational Dynamics of Hyaluronan in Solution. 2. Mode-Coupling Diffusion Approach to Oligomers" (Insieme di parole chiave)
• Keywords of "Anomalous Wetting Layer at the Au(111) Surface" (Insieme di parole chiave)
• Keywords of "Computational analysis of current and noise properties of a single open ion channel" (Insieme di parole chiave)
• Parole chiave di "Role of dipolar correlations in the infrared spectra of water and ice" (Insieme di parole chiave)
• Parole chiave di "Aging in a Laponite colloidal suspension: A Brownian dynamics simulation study" (Insieme di parole chiave)
• Parole chiave di "Self-assembling DNA dendrimers: A numerical study" (Insieme di parole chiave)
• Parole chiave di "Probing the cooperative dynamics varying the side-chain length of poly(alkyl acrylate)s: ESR experiments" (Insieme di parole chiave)
• Keywords of "VARICELLA: a variable-cell direct space method for structure determination from powder diffraction data" (Insieme di parole chiave)
• Parole chiave di "Heme Proteins: The Role of Solvent in the Dynamics of Gates and Portals" (Insieme di parole chiave)
• Parole chiave di "First-Principles Study of Water Ice Adsorption on the Methyl-Terminated Si(111) Surface" (Insieme di parole chiave)
• Parole chiave di "Two distinct heme distal site states define Cerebratulus lacteus mini-hemoglobin oxygen affinity" (Insieme di parole chiave)
• Parole chiave di "Analyzing pathogenic mutations of C5 domain from cardiac myosin binding protein C through MD simulations" (Insieme di parole chiave)
• Keywords of "Reaction Pathways for Oxygen Evolution Promoted by Cobalt Catalyst" (Insieme di parole chiave)
• Parole chiave di "Velocity plateaus and jumps in carbon nanotube sliding" (Insieme di parole chiave)
• Keywords of "Atomistic modeling of brittleness in covalent materials" (Insieme di parole chiave)
• Parole chiave di "Dipolar correlations and the dielectric permittivity of water" (Insieme di parole chiave)
• Keywords of "Interaction between the DNA model base 9-ethylguanine and a group of ruthenium polypyridyl complexes: Kinetics and conformational temperature dependence" (Insieme di parole chiave)
• Keywords of "Effect of temperature and pressure on the structural (alpha-) and the true Johari-Goldstein (beta-) relaxation in binary mixtures" (Insieme di parole chiave)
• Keywords of "Stability and dynamics of the porcine odorant-binding protein" (Insieme di parole chiave)
• Keywords of "Structural characterization of Ni2Si pseudoepitaxial transrotational structures on [001] Si" (Insieme di parole chiave)
• Keywords of "CO escape from myoglobin with metadynamics simulations" (Insieme di parole chiave)
• Keywords of "Understanding fragility in supercooled Lennard-Jones mixtures. II. Potential energy surface" (Insieme di parole chiave)
• Keywords of "Charged chromophoric units in protonated rare-gas clusters: A dynamical simulation" (Insieme di parole chiave)
• Keywords of "Acidification of three-dimensional emeraldine polymers: Search for minimum energy paths from base to salt" (Insieme di parole chiave)
• Keywords of "Pressure effect on water dynamics in tert-butyl alcohol/water solutions" (Insieme di parole chiave)
• Keywords of "Comment on 'Decrease in the configurational entropy during a melt's polymerization' [Chem. Phys. 305 (2004) 231]" (Insieme di parole chiave)
• Keywords of "Formumation of improved basis sets for the study of polymer dynamics through diffusion theory methods" (Insieme di parole chiave)
• Keywords of "Temperature-dependent dynamics of water confined in Nafion membranes" (Insieme di parole chiave)
• Parole chiave di "Atomic scale simulations of vapor cooled carbon clusters" (Insieme di parole chiave)
• Keywords of "Controlling the protein dynamical transition with sugar-based bioprotectant matrices: A neutron scattering study" (Insieme di parole chiave)
• Keywords of "Spinodal of supercooled polarizable water" (Insieme di parole chiave)
• Keywords of "String method in collective variables: Minimum free energy paths and isocommittor surfaces" (Insieme di parole chiave)
• Keywords of "Excluded-volume corrections to the single-chain static properties of a polymer melt: Temperature, density and potential effects" (Insieme di parole chiave)
• Keywords of "Optical properties of ZnO nanostructures: a hybrid DFT/TDDFT investigation" (Insieme di parole chiave)
• Parole chiave di "The Conformations of Amino Acids on a Gold(111) Surface" (Insieme di parole chiave)
• Parole chiave di "Electrical conductivity of warm expanded Al" (Insieme di parole chiave)
• Keywords of "MEMBPLUGIN: studying membrane complexity in VMD" (Insieme di parole chiave)
• Parole chiave di "Density functional theory study of formic acid adsorption on anatase TiO2(001): Geometries, energetics, and effects of coverage, hydration, and reconstruction" (Insieme di parole chiave)
• Parole chiave di "Structure and function of vanadium haloperoxidases" (Insieme di parole chiave)
• Parole chiave di "Structural, dynamical and functional aspects of the inner motions in the blue copper protein azurin" (Insieme di parole chiave)
• Keywords of "Wrapped-around Models for the Lac Operon Complex" (Insieme di parole chiave)
• Keywords of "Ab initio exploration of rearrangement reactions: intramolecular hydrogen scrambling processes in acetone" (Insieme di parole chiave)
• Keywords of "Binding of phosphinate and phosphonate inhibitors to aspartic proteases: A first-principles study" (Insieme di parole chiave)
• Keywords of "Computational analysis of folding and mutation properties of C5 domain from Myosin Binding Protein C" (Insieme di parole chiave)
• Parole chiave di "Silica through the eyes of colloidal models--when glass is a gel" (Insieme di parole chiave)
• Parole chiave di "The combined effects of temperature and polymerization rate changes on the real-time conduction and relaxation of a liquid, and the evolution of localized motions" (Insieme di parole chiave)
• Keywords of "Role of protein frame and solvent for the redox properties of azurin from Pseudomonas aeruginosa" (Insieme di parole chiave)