Works matching DE "MOLECULAR force constants"
Results: 817
Open-loop swept frequency response of nonlinear structures subjected to weak coupling: Open-loop swept frequency...: Z. Gabos, Z. Dombovari.
- Published in:
- Nonlinear Dynamics, 2025, v. 113, n. 6, p. 5091, doi. 10.1007/s11071-024-10546-6
- By:
- Publication type:
- Article
Atomic molecular dynamics simulation advances of de novo-designed proteins.
- Published in:
- Quarterly Reviews of Biophysics, 2024, v. 57, p. 1, doi. 10.1017/S0033583524000131
- Publication type:
- Article
Coarse‐Grained Molecular Simulation of Polymers Supported by the Use of the SAFT‐γ$\gamma$ Mie Equation of State.
- Published in:
- Macromolecular Theory & Simulations, 2022, v. 31, n. 1, p. 1, doi. 10.1002/mats.202100031
- By:
- Publication type:
- Article
Modeling of Nonlinear Optical Activity of Epoxyamine Oligomers with Binary Chromophore Groups.
- Published in:
- Macromolecular Theory & Simulations, 2016, v. 25, n. 6, p. 591, doi. 10.1002/mats.201600054
- By:
- Publication type:
- Article
Systematic Coarse Graining of a High-Performance Polyimide.
- Published in:
- Macromolecular Theory & Simulations, 2015, v. 24, n. 5, p. 513, doi. 10.1002/mats.201500009
- By:
- Publication type:
- Article
Analysis of the nonlinear optical properties, vibrational spectra, DFT method and photovoltaic performance of cyanidin-3-rutinoside chloride.
- Published in:
- Optical & Quantum Electronics, 2024, v. 56, n. 8, p. 1, doi. 10.1007/s11082-024-07294-7
- By:
- Publication type:
- Article
Investigation of the structural, optical, electrical, and photovoltaic characteristics of nanostructured Ce-doped BaTiO<sub>3</sub> by a modified combustion method.
- Published in:
- Optical & Quantum Electronics, 2024, v. 56, n. 1, p. 1, doi. 10.1007/s11082-023-05686-9
- By:
- Publication type:
- Article
Lattice dynamic, optical, and mechanical properties of nanostructured gallium antimonide (GaSb) semiconductor under the effect of pressure.
- Published in:
- Optical & Quantum Electronics, 2023, v. 55, n. 13, p. 1, doi. 10.1007/s11082-023-05421-4
- By:
- Publication type:
- Article
New exact solutions of time conformable fractional Klein Kramer equation.
- Published in:
- Optical & Quantum Electronics, 2021, v. 53, n. 12, p. 1, doi. 10.1007/s11082-021-03343-7
- By:
- Publication type:
- Article
Biomechanical evaluation of flash-frozen and cryo-sectioned papillary muscle samples by using sinusoidal analysis: cross-bridge kinetics and the effect of partial Ca<sup>2+</sup> activation.
- Published in:
- Journal of Muscle Research & Cell Motility, 2024, v. 45, n. 3, p. 95, doi. 10.1007/s10974-024-09667-7
- By:
- Publication type:
- Article
The effect of gender and obesity in modulating cross-bridge function in cardiac muscle fibers.
- Published in:
- Journal of Muscle Research & Cell Motility, 2022, v. 43, n. 4, p. 157, doi. 10.1007/s10974-022-09627-z
- By:
- Publication type:
- Article
An automatic robot polishing control method for compound surface comprising plane and curved surfaces.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2024, v. 132, n. 7/8, p. 3801, doi. 10.1007/s00170-024-13319-y
- By:
- Publication type:
- Article
Study on the constant force control of aero-engine blade grinding robot considering time delay.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2024, v. 131, n. 3/4, p. 1427, doi. 10.1007/s00170-024-13029-5
- By:
- Publication type:
- Article
The constant force control based on an optimized environmental model for the robotic lapping of curved surface.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2023, v. 127, n. 11/12, p. 5051, doi. 10.1007/s00170-023-11764-9
- By:
- Publication type:
- Article
Bio-inspired design, modeling, and 3D printing of lattice-based scale model scooter decks.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2023, v. 126, n. 7/8, p. 2887, doi. 10.1007/s00170-023-11185-8
- By:
- Publication type:
- Article
Research on the algorithm of constant force grinding controller based on reinforcement learning PPO.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2023, v. 126, n. 7/8, p. 2975, doi. 10.1007/s00170-023-11129-2
- By:
- Publication type:
- Article
PD-adaptive variable impedance constant force control of macro-mini robot for compliant grinding and polishing.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2023, v. 124, n. 7/8, p. 2149, doi. 10.1007/s00170-022-10405-x
- By:
- Publication type:
- Article
Micro-cutting of holes by centrifugal force.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2023, v. 124, n. 5/6, p. 1437, doi. 10.1007/s00170-022-10581-w
- By:
- Publication type:
- Article
An improved rational Bezier model for pneumatic constant force control device of robotic polishing with hysteretic nonlinearity.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2022, v. 123, n. 1/2, p. 665, doi. 10.1007/s00170-022-10193-4
- By:
- Publication type:
- Article
Research on constant force polishing method of curved mold based on position adaptive impedance control.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2022, v. 122, n. 2, p. 697, doi. 10.1007/s00170-022-09943-1
- By:
- Publication type:
- Article
Constant force tracking using online stiffness and reverse damping force of variable impedance controller for robotic polishing.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2022, v. 121, n. 9/10, p. 5855, doi. 10.1007/s00170-022-09599-x
- By:
- Publication type:
- Article
Flexible stratification method based on constant cutting force for machining blade surfaces.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2022, v. 120, n. 1/2, p. 159, doi. 10.1007/s00170-020-06551-9
- By:
- Publication type:
- Article
Real-time normal contact force control for robotic surface processing of workpieces without a priori geometric model.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2022, v. 119, n. 3/4, p. 2537, doi. 10.1007/s00170-021-07497-2
- By:
- Publication type:
- Article
Design of a spatial constant-force end-effector for polishing/deburring operations.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2021, v. 116, n. 11/12, p. 3507, doi. 10.1007/s00170-021-07579-1
- By:
- Publication type:
- Article
Research on deformation prediction and error compensation in precision turning of micro-shafts.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2020, v. 110, n. 5/6, p. 1575, doi. 10.1007/s00170-020-05904-8
- By:
- Publication type:
- Article
Double-action bending for eliminating springback in hat-shaped bending of advanced high-strength steel sheet.
- Published in:
- International Journal of Advanced Manufacturing Technology, 2020, v. 106, n. 5/6, p. 1855, doi. 10.1007/s00170-019-04678-y
- By:
- Publication type:
- Article
Intramolecular force field for carboxylate Pt(II)-complexes.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2022, v. 141, n. 8, p. 1, doi. 10.1007/s00214-022-02901-w
- By:
- Publication type:
- Article
Molecular dynamics simulation of the Pb(II) coordination in biological media via cationic dummy atom models.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2021, v. 140, n. 2, p. 1, doi. 10.1007/s00214-021-02718-z
- By:
- Publication type:
- Article
Effects of nitrogen atoms on the stability and reactivity of tricyclic boracarbenes by DFT.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2020, v. 139, n. 8, p. N.PAG, doi. 10.1007/s00214-020-02659-z
- By:
- Publication type:
- Article
Theoretical and experimental revision of the water bending excitation in the OH/OD + GeH<sub>4</sub> reactions.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2019, v. 138, n. 10, p. N.PAG, doi. 10.1007/s00214-019-2506-2
- By:
- Publication type:
- Article
New insights into Fe–H2 and Fe–H- bonding of a [NiFe] hydrogenase mimic: a local vibrational mode study.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2019, v. 138, n. 6, p. N.PAG, doi. 10.1007/s00214-019-2463-9
- By:
- Publication type:
- Article
Developing accurate intramolecular force fields for conjugated systems through explicit coupling terms.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2018, v. 137, n. 6, p. 1, doi. 10.1007/s00214-018-2254-8
- By:
- Publication type:
- Article
Evaluation of ReaxFF-lg force fields for use in molecular dynamics simulations of sucrose.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 9, p. 1, doi. 10.1007/s00214-016-1973-y
- By:
- Publication type:
- Article
Experimental and density functional study on electronic structure and electronic circular dichroism of the phenylpyrazole insecticides enantiomers and the probable chiral catabolites.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2016, v. 135, n. 5, p. 1, doi. 10.1007/s00214-016-1892-y
- By:
- Publication type:
- Article
Development of force field parameters for cyclopentane-modified peptide nucleic acids.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2015, v. 134, n. 5, p. 1, doi. 10.1007/s00214-015-1671-1
- By:
- Publication type:
- Article
A molecular dynamics study of the evolution from the formation of the C6F6–(H2O)n small aggregates to the C6F6 solvation.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2015, v. 134, n. 5, p. 1, doi. 10.1007/s00214-015-1662-2
- By:
- Publication type:
- Article
The prediction of atomic kinetic energies from coordinates of surrounding atoms using kriging machine learning.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2014, v. 133, n. 7, p. 1, doi. 10.1007/s00214-014-1499-0
- By:
- Publication type:
- Article
Development of ABEEM σπ polarizable force field for oxidized adenine base pairs: investigation of the interaction and mutagenic mechanism.
- Published in:
- Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2014, v. 133, n. 4, p. 1, doi. 10.1007/s00214-014-1469-6
- By:
- Publication type:
- Article
MemGen: a general web server for the setup of lipid membrane simulation systems.
- Published in:
- Bioinformatics, 2015, v. 31, n. 17, p. 2897, doi. 10.1093/bioinformatics/btv292
- By:
- Publication type:
- Article
Improved protein–ligand binding affinity prediction by using a curvature-dependent surface-area model.
- Published in:
- Bioinformatics, 2014, v. 30, n. 12, p. 1674, doi. 10.1093/bioinformatics/btu104
- By:
- Publication type:
- Article
MemBuilder: a web-based graphical interface to build heterogeneously mixed membrane bilayers for the GROMACS biomolecular simulation program.
- Published in:
- Bioinformatics, 2014, v. 30, n. 3, p. 439, doi. 10.1093/bioinformatics/btt680
- By:
- Publication type:
- Article
Predicting the adsorption of n-perfluorohexane (n-C<sub>6</sub>F<sub>14</sub>) on BAM-P109 activated carbon using an ab initio force field.
- Published in:
- Adsorption Science & Technology, 2016, v. 34, n. 1, p. 110, doi. 10.1177/0263617415619532
- By:
- Publication type:
- Article
Predicting the adsorption of n-perfluorohexane in BAM-P109 standard activated carbon by molecular simulation using SAFT-γ Mie coarse-grained force fields.
- Published in:
- Adsorption Science & Technology, 2016, v. 34, n. 1, p. 64, doi. 10.1177/0263617415619528
- By:
- Publication type:
- Article
Neural Network Potentials for Enabling Advanced Small-Molecule Drug Discovery and Generative Design.
- Published in:
- GEN Biotechnology, 2024, v. 3, n. 3, p. 119, doi. 10.1089/genbio.2024.0011
- By:
- Publication type:
- Article
Probing the interfacial coupling in ternary van der Waals heterostructures.
- Published in:
- NPJ 2D Materials & Applications, 2022, v. 6, n. 1, p. 1, doi. 10.1038/s41699-022-00362-0
- By:
- Publication type:
- Article
Local vibrational modes of natural isotopes of substitutional oxygen in CdTe.
- Published in:
- Turkish Journal of Physics, 2020, v. 44, n. 3, p. 247, doi. 10.3906/fiz-1911-14
- By:
- Publication type:
- Article
Study of zone center phonons in wolframite ZnWO<sub>4</sub>.
- Published in:
- Turkish Journal of Physics, 2013, v. 37, n. 1, p. 107, doi. 10.3906/fiz-1205-7
- By:
- Publication type:
- Article
A molecular dynamics study on the liquid SbCl 5 and SbF 5 using force fields derived from quantum chemical calculations.
- Published in:
- Physics & Chemistry of Liquids, 2013, v. 51, n. 6, p. 695, doi. 10.1080/00319104.2013.782495
- By:
- Publication type:
- Article
Asymptotics for a diffusion-perturbed risk model with dependence structures, constant interest force, and a random number of delayed claims.
- Published in:
- Stochastic Models, 2024, v. 40, n. 1, p. 97, doi. 10.1080/15326349.2023.2209146
- By:
- Publication type:
- Article
On asymptotic finite-time ruin probabilities of a new bidimensional risk model with constant interest force and dependent claims.
- Published in:
- Stochastic Models, 2021, v. 37, n. 4, p. 608, doi. 10.1080/15326349.2021.1946408
- By:
- Publication type:
- Article