Cited in
(only showing first 100 items - show all)- scientific article; zbMATH DE number 7325145 (Why is no real title available?)
- Co-evolution and information signals in biological sequences
- Armchair or Zigzag? A tool for characterizing graphene edge
- A study of mechanical properties of pure and nitrogen-doped ultrananocrystalline diamond films under various loading conditions
- Insights into the molecular mechanisms of protein-ligand interactions by molecular docking and molecular dynamics simulation: a case of oligopeptide binding protein
- Combined MPM-DEM for Simulating the Interaction Between Solid Elements and Fluid Particles
- Metadynamics study of mutant human interferon-gamma forms
- Revisiting chameleon sequences in the protein data bank
- Fast analysis of molecular dynamics trajectories with graphics processing units -- radial distribution function histogramming
- Browndye: A software package for Brownian dynamics
- The loading history and crystal orientation effects on the size-dependency of single crystal diamond properties
- Large-scale molecular dynamics simulation of flow under complex structure of endothelial glycocalyx
- Geometry-guided computation of 3D electrostatics for large biomolecules
- Myoglobin ligand gate mechanism analysis by a novel 3D visualization technique
- Using sacrificial cell spheroids for the bioprinting of perfusable 3D tissue and organ constructs: a computational study
- Large deformation and fracture mechanics of a beta-helical protein nanotube: Atomistic and continuum modeling
- Hydrophobic collapse in (in silico) protein folding
- Coupled applications on distributed resources
- Implication of crystal water molecules in inhibitor binding at ALR2 active site
- Analyses of tensile deformation of nanocrystalline \(\alpha-\text{Fe}_2\text{O}_3+fcc-\)Al composites using molecular dynamics simulations
- Numerical methods for the Poisson-Fermi equation in electrolytes
- Adaptive multiscale modeling of polymeric materials with Arlequin coupling and goals algorithms
- Quantum dynamics with the parallel transport gauge
- Accuracy limits of the blob model for a flexible polymer confined inside a cylindrical nano-channel
- Dynamic pull-in instability of multilayer graphene NEMSs: non-classical continuum model and molecular dynamics simulations
- PROSIGN: a method for protein secondary structure assignment based on three-dimensional coordinates of consecutive \(C_\alpha \) atoms
- Multiscale modeling using goal-oriented adaptivity and numerical homogenization. I: Mathematical formulation and numerical results
- Efficient perturbation analysis of elastic network models -- application to acetylcholinesterase of T. Californica
- NAMD2: Greater scalability for parallel molecular dynamics
- A boundary element formulation of protein electrostatics with explicit ions
- Folding of multi-layer graphene sheets induced by van der Waals interaction
- Multiscale Hybrid Modeling of Proteins in Solvent: SARS-CoV2 Spike Protein as Test Case for Lattice Boltzmann – All Atom Molecular Dynamics Coupling
- A treecode-accelerated boundary integral Poisson-Boltzmann solver for electrostatics of solvated biomolecules
- Combined grain size, strain rate and loading condition effects on mechanical behavior of nanocrystalline Cu under high strain rates
- Evolutionary de Rham-Hodge method
- Molecular dynamics simulation of peeling a DNA molecule on substrate
- Collective mode mining from molecular dynamics simulations: a comparative approach
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