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A simple atomistic model for the simulation of the gel phase of lipid bilayers
EUROPEAN PHYSICAL JOURNAL E
Time-trimming tricks for dynamic simulations: Splitting force updates to reduce computational work
STRUCTURE
Metric-based parameterizations for multi-step unconstrained optimization
COMPUTATIONAL OPTIMIZATION AND APPLICATIONS
Spline techniques for solving first-order evolution equations in Banach spaces
COMPUTERS & MATHEMATICS WITH APPLICATIONS
A new formalism for molecular dynamics in internal coordinates
CHEMICAL PHYSICS
NGP(G)-stability of linear multistep methods for systems of generalized neutral delay differential equations
APPLIED MATHEMATICS AND MECHANICS-ENGLISH EDITION
Explicit pseudo two-step RKN methods with stepsize control
APPLIED NUMERICAL MATHEMATICS
On variable-step methods for the numerical solution of Schrodinger equation and related problems
COMPUTERS & CHEMISTRY
On the convergence rate of operator splitting for Hamilton-Jacobi equations with source terms
SIAM JOURNAL ON NUMERICAL ANALYSIS
Solving initial value problems by differential quadrature method - Part 2:second- and higher-order equations
INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN ENGINEERING
Canonical fractional-step methods and consistent boundary conditions for the incompressible Navier-Stokes equations
JOURNAL OF COMPUTATIONAL PHYSICS
Langevin stabilization of molecular dynamics
JOURNAL OF CHEMICAL PHYSICS
Sixth order non-dissipative C-1-spline collocation method for oscillatory ordinary initial value problems
INTERNATIONAL JOURNAL OF COMPUTER MATHEMATICS
MBO(N)D: A multibody method for long-time molecular dynamics simulations
JOURNAL OF COMPUTATIONAL CHEMISTRY
Rational methods with optimal order of convergence for partial differential equations
APPLIED NUMERICAL MATHEMATICS
Fractional step methods for thermo-mechanical damage analyses at transientelevated temperatures
INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN ENGINEERING
A two step method for the numerical integration of stiff differential equations
INTERNATIONAL JOURNAL OF COMPUTER MATHEMATICS
Order conditions for numerical integrators obtained by composing simpler integrators
PHILOSOPHICAL TRANSACTIONS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL PHYSICAL AND ENGINEERING SCIENCES
Analysis and design of digital simulation via control theory
JOURNAL OF VIBRATION AND CONTROL
Cheap error estimation for Runge-Kutta methods
SIAM JOURNAL ON SCIENTIFIC COMPUTING
An error analysis of streaklines as curves
JAPAN JOURNAL OF INDUSTRIAL AND APPLIED MATHEMATICS
Conservative spline methods for seconnd-order IVPs of ODEs
COMPUTERS & MATHEMATICS WITH APPLICATIONS
A general class of explicit pseudo two-step RKN methods on parallel computers
COMPUTERS & MATHEMATICS WITH APPLICATIONS
Singly-implicit stabilized extended one-step methods for second-order initial-value problems with oscillating solutions
MATHEMATICAL AND COMPUTER MODELLING
On the convergence of two-step methods generated by point-to-point operators
APPLIED MATHEMATICS AND COMPUTATION
Numerical solution of implicit neutral functional differential equations
SIAM JOURNAL ON NUMERICAL ANALYSIS
Backward error analysis for multistep methods
NUMERISCHE MATHEMATIK
The NGP-stability of Runge-Kutta methods for systems of neutral delay differential equations
NUMERISCHE MATHEMATIK
Complex-time-step methods for transient analysis
INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN ENGINEERING
Higher-order accurate least-squares methods for first-order initial value problems
INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN ENGINEERING
Algorithmic challenges in computational molecular biophysics
JOURNAL OF COMPUTATIONAL PHYSICS
Masking resonance artifacts in force-splitting methods for biomolecular simulations by extrapolative Langevin dynamics
JOURNAL OF COMPUTATIONAL PHYSICS
Explicit pseudo two-step Runge-Kutta methods for parallel computers
INTERNATIONAL JOURNAL OF COMPUTER MATHEMATICS
High-accuracy non-dissipative extended one-step methods for oscillatory problems
INTERNATIONAL JOURNAL OF COMPUTER MATHEMATICS
NUMERICAL EXPERIMENTS WITH SOME EXPLICIT PSEUDO 2-STEP RK METHODS ON A SHARED-MEMORY COMPUTER
Computers & mathematics with applications (1987)
A fractional-step method for the incompressible Navier-Stokes equations related to a predictor-multicorrector algorithm
INTERNATIONAL JOURNAL FOR NUMERICAL METHODS IN FLUIDS
A MULTILEVEL METHOD FOR THE RESOLUTION OF A STOCHASTIC WEAKLY DAMPED NONLINEAR SCHRODINGER-EQUATION
Applied numerical mathematics
CONVERGENCE ANALYSIS FOR OPERATOR-SPLITTING METHODS APPLIED TO CONSERVATION-LAWS WITH STIFF SOURCE TERMS
SIAM journal on numerical analysis (Print)
OVERCOMING STABILITY LIMITATIONS IN BIOMOLECULAR DYNAMICS - I - COMBINING FORCE SPLITTING VIA EXTRAPOLATION WITH LANGEVIN DYNAMICS IN LN
The Journal of chemical physics
EXTRAPOLATION VERSUS IMPULSE IN MULTIPLE-TIMESTEPPING SCHEMES - II - LINEAR-ANALYSIS AND APPLICATIONS TO NEWTONIAN AND LANGEVIN DYNAMICS
The Journal of chemical physics
ELECTROSTATIC CALCULATIONS AND MULTIPLE TIME SCALES IN MOLECULAR-DYNAMICS SIMULATION OF FLEXIBLE MOLECULAR-SYSTEMS
The Journal of chemical physics
NONDISSIPATIVE EXTENDED ONE-STEP METHODS FOR OSCILLATORY PROBLEMS
International journal of computer mathematics (Print)
BIOMOLECULAR DYNAMICS AT LONG TIMESTEPS - BRIDGING THE TIMESCALE GAP BETWEEN SIMULATION AND EXPERIMENTATION
Annual review of biophysics and biomolecular structure
MIXED PROBLEMS FOR THE TIME-DEPENDENT TELEGRAPH EQUATION - CONTINUOUSNUMERICAL-SOLUTIONS WITH A-PRIORI ERROR-BOUNDS
Mathematical and computer modelling
HYBRID SPECTRAL FINITE-DIFFERENCE SIMULATIONS OF STRATIFIED TURBULENTFLOWS ON DISTRIBUTED-MEMORY ARCHITECTURES
International journal for numerical methods in fluids
THE CONVERGENCE OF 2 NEWTON-LIKE METHODS FOR SOLVING BLOCK NONLINEAR EQUATIONS AND A CLASS OF R-POINT (R-ORDER A-STABLE ONE-BLOCK METHODS(1)ST)
Applied numerical mathematics
CONTINUOUS RUNGE-KUTTA METHODS FOR NEUTRAL VOLTERRA INTEGRODIFFERENTIAL EQUATIONS WITH DELAY
Applied numerical mathematics
ORDER CONDITIONS FOR 2-STEP RUNGE-KUTTA METHODS
Applied numerical mathematics
ORDER CONDITIONS FOR GENERAL 2-STEP RUNGE-KUTTA METHODS
SIAM journal on numerical analysis
OPTIMAL L-1-RATE OF CONVERGENCE FOR THE VISCOSITY METHOD AND MONOTONESCHEME TO PIECEWISE-CONSTANT SOLUTIONS WITH SHOCKS
SIAM journal on numerical analysis
HIGHLY CONTINUOUS INTERPOLANTS FOR ONE-STEP ODE SOLVERS AND THEIR APPLICATION TO RUNGE-KUTTA METHODS
SIAM journal on numerical analysis
OPTIMAL P-CYCLIC SOR FOR COMPLEX SPECTRA
Linear algebra and its applications
WAVE-FORM RELAXATION METHODS FOR FUNCTIONAL-DIFFERENTIAL SYSTEMS OF NEUTRAL TYPE
Journal of mathematical analysis and applications
OPERATOR-SPLITTING INTEGRATORS FOR CONSTANT-TEMPERATURE MOLECULAR-DYNAMICS
The Journal of chemical physics
A VARIABLE-STEP VARIABLE-ORDER ALGORITHM FOR SYSTEMS OF STIFF ODES
International journal of computer mathematics
MOLECULAR-DYNAMICS WITH THE MASSIVELY-PARALLEL APE COMPUTERS
Computer physics communications
PARALLEL MULTILEVEL PRECONDITIONED CONJUGATE-GRADIENT APPROACH TO VARIABLE-CHARGE MOLECULAR-DYNAMICS
Computer physics communications
MULTIPLE TIME-STEP INTEGRATORS AND MOMENTUM CONSERVATION
Computer physics communications
HOW HORMONE-RECEPTOR DNA-BINDING AFFECTS NUCLEOSOMAL DNA - THE ROLE OF SYMMETRY
Biophysical journal
COMPUTER-SIMULATIONS OF THE OMPF PORIN FROM THE OUTER-MEMBRANE OF ESCHERICHIA-COLI
Biophysical journal
RESTRICTED STEP AND LEVENBERG-MARQUARDT TECHNIQUES IN PROXIMAL BUNDLEMETHODS FOR NONCONVEX NONDIFFERENTIABLE OPTIMIZATION
SIAM journal on optimization
MULTISTRIDE L-STABLE 4TH-ORDER METHODS FOR THE NUMERICAL-SOLUTION OF ODES
Computers & mathematics with applications
EMBEDDED METHODS FOR THE NUMERICAL-SOLUTION OF THE SCHRODINGER-EQUATION
Computers & mathematics with applications
INVARIANT-MANIFOLDS AND GLOBAL ERROR-ESTIMATES OF NUMERICAL-INTEGRATION SCHEMES APPLIED TO STIFF SYSTEMS OF SINGULAR PERTURBATION TYPE .2. LINEAR MULTISTEP METHODS
Numerische Mathematik
A GENERAL-THEORY OF STABILIZED EXTENDED ONE-STEP METHODS FOR ODES
International journal of computer mathematics
A CLASS OF STABILIZED EXTENDED ONE-STEP METHODS FOR THE NUMERICAL-SOLUTION OF ODES
Computers & mathematics with applications
USING DYNAMICAL-SYSTEMS METHODS TO SOLVE MINIMIZATION PROBLEMS
Applied numerical mathematics
PARALLEL ONE-STEP METHODS WITH MINIMAL PARALLEL STAGES
Applied numerical mathematics
A GENERAL-CLASS OF 2-STEP RUNGE-KUTTA METHODS FOR ORDINARY DIFFERENTIAL-EQUATIONS
SIAM journal on numerical analysis
STABILITY ANALYSIS OF THETA-METHODS FOR NEUTRAL FUNCTIONAL-DIFFERENTIAL EQUATIONS
Numerische Mathematik
ADAPTIVE 2-STEP METHODS FOR SEMIDISCRETIZED WAVE-EQUATIONS
International journal for numerical methods in engineering
UPPER SEMICONTINUITY OF ATTRACTORS FOR LINEAR MULTISTEP METHODS APPROXIMATING SECTORIAL EVOLUTION-EQUATIONS
Mathematics of computation
A FAMILY OF 4-STEP EXPONENTIAL FITTED METHODS FOR THE NUMERICAL-INTEGRATION OF THE RADIAL SCHRODINGER-EQUATION
Computers & mathematics with applications
ON THE ACCURACY OF FRACTIONAL STEP METHODS FOR CONSERVATION-LAWS IN 2DIMENSIONS
SIAM journal on numerical analysis
A NEW FAMILY OF EXPLICIT TIME INTEGRATION METHODS FOR LINEAR AND NONLINEAR STRUCTURAL DYNAMICS
International journal for numerical methods in engineering
ON SIMULTANEOUS FACTORING OF A POLYNOMIAL
International journal of computer mathematics