GPU/CPU Algorithm for Generalized Born/Solvent-Accessible Surface Area Implicit Solvent Calculations.
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Principles and Overview of Sampling Methods for Modeling Macromolecular Structure and DynamicsMolecular dynamics simulations of biological membranes and membrane proteins using enhanced conformational sampling algorithmsDesign and application of implicit solvent models in biomolecular simulationsMolecular dynamics simulations on networks of heparin and collagen.Study of the affinity between the protein kinase PKA and peptide substrates derived from kemptide using molecular dynamics simulations and MM/GBSA.Multi-kinase inhibitors can associate with heat shock proteins through their NH2-termini by which they suppress chaperone functionDetermining Atomistic SAXS Models of Tri-Ubiquitin Chains from Bayesian Analysis of Accelerated Molecular Dynamics Simulations.Advanced molecular dynamics simulation methods for kinase drug discovery.Computation of Hemagglutinin Free Energy Difference by the Confinement Method.Structural Probing, Screening and Structure-Based Drug Repositioning Insights into the Identification of Potential Cox-2 Inhibitors from Selective Coxibs.Accuracy assessment of the linear Poisson-Boltzmann equation and reparametrization of the OBC generalized Born model for nucleic acids and nucleic acid-protein complexes.Geometric Detection Algorithms for Cavities on Protein Surfaces in Molecular Graphics: A Survey.
P2860
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P2860
GPU/CPU Algorithm for Generalized Born/Solvent-Accessible Surface Area Implicit Solvent Calculations.
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2012 nî lūn-bûn
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2012年学术文章
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name
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@ast
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@en
type
label
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@ast
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@en
prefLabel
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@ast
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@en
P2860
P356
P1476
GPU/CPU Algorithm for Generali ...... Implicit Solvent Calculations.
@en
P2093
David E Tanner
James C Phillips
P2860
P304
P356
10.1021/CT3003089
P577
2012-06-15T00:00:00Z