Preferred Name

molecular dynamics simulation

Synonyms

molecular-dynamics simulations

MD simulation

molecular-dynamics simulation

molecular dynamic simulation

molecular dynamic simulations

MD simulations

molecular dynamics simulations

molecular dynamics (MD) simulation

molecular dynamics (MD) simulations

Molecular dynamics simulations

Definitions

Simulate molecular (typically protein) conformation using a computational model of physicalal forces and computer simulation. source: EDAM

ID

http://scai.fraunhofer.de/HuPSON#SCAIVPH_00000367

definition

Simulate molecular (typically protein) conformation using a computational model of physicalal forces and computer simulation. source: EDAM

exact_synonym

molecular-dynamics simulations

MD simulation

molecular-dynamics simulation

molecular dynamic simulation

molecular dynamic simulations

MD simulations

molecular dynamics simulations

molecular dynamics (MD) simulation

molecular dynamics (MD) simulations

Molecular dynamics simulations

label

molecular dynamics simulation

PMID

2215695

prefixIRI

hupson:SCAIVPH_00000367

prefLabel

molecular dynamics simulation

related_synonym

hybrid MCM-41: molecular simulation

Molecular simulations

Monte Carlo molecular simulation

classical molecular dynamics

reverse coarse-graining

coarse-grained molecular dynamics simulation

coarse-grained molecular dynamics simulations

Ab Initio Molecular Dynamics Simulations

Biomolecular Simulation

ab initio Car-Parrinello Molecular Dynamics (CPMD) simulations

ab initio molecular dynamics

molecular dynamic (MD) simulations

Non-adiabatic molecular dynamics simulations

conventional molecular simulation

ab initio Car-Parrinello Molecular Dynamics (CPMD) simulation

ab initio molecular dynamics simulation

coarse-grained molecular dynamics (MD) simulations

coarse-grained MD

Quantum molecular dynamic simulations

model-building simulation

Car-Parrinello

Car-Parrinello dynamical simulations

ab initio molecular dynamics methods

multiscale molecular dynamics simulations

hybrid MCM-41: molecular simulations

CPMD simulations

AIMD simulation

Ab initio molecular dynamics (AIMD) simulation

Ab initio molecular dynamics (AIMD) simulations

free MD simulation

free MD simulations

Discrete molecular dynamics simulation

AIMD simulations

CPMD interactions

molecular simulation analysis

molecular dynamics analysis

coarse-grained (CG) molecular dynamics (MD) simulations

coarse-grained (CG) molecular dynamics (MD) simulation

molecular dynamics studies

ab initio molecular dynamics simulations

coarse-grained molecular dynamics (MD) simulation

MD-based approach

Car-Parrinello dynamical simulation

model-building simulations

Parallel Discrete Molecular Dynamics Simulation

AIMD

CGMD

DMD

EVB-MD

rCG

subClassOf

http://scai.fraunhofer.de/HuPSON#SCAIVPH_00000366

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