(Q30373023)

28 September 2017

Best bang for your buck: GPU nodes for GROMACS biomolecular simulations. (English)

1 reference

28 September 2017

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Carsten Kutzner

1

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28 September 2017

Szilárd Páll

2

1 reference

28 September 2017

Martin Fechner

3

1 reference

28 September 2017

Ansgar Esztermann

4

1 reference

28 September 2017

Bert L de Groot

5

1 reference

28 September 2017

Helmut Grubmüller

6

1 reference

28 September 2017

4 August 2015

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Journal of Computational Chemistry

28 September 2017

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28 September 2017

36

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28 September 2017

26

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28 September 2017

1990-2008

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maintained by WikiProject

28 September 2017

WikiProject Software

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cites work

GROMACS 4: Algorithms for Highly Efficient, Load-Balanced, and Scalable Molecular Simulation

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

Lennard-Jones Lattice Summation in Bilayer Simulations Has Critical Effects on Surface Tension and Lipid Properties

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

Energy barriers and driving forces in tRNA translocation through the ribosome

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

GROMACS 4.5: a high-throughput and highly parallel open source molecular simulation toolkit

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

Optimization of parameters for molecular dynamics simulation using smooth particle-mesh Ewald in GROMACS 4.5.

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

CHARMM: the biomolecular simulation program

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

Scalable molecular dynamics with NAMD

4 June 2018

1 reference

https://eutils.ncbi.nlm.nih.gov/entrez/eutils/elink.fcgi?dbfrom=pmc&linkname=pmc_refs_pubmed&retmode=json&id=5042102

ACEMD: Accelerating Biomolecular Dynamics in the Microsecond Time Scale.

4 June 2018

1 reference

Crossref

https://api.crossref.org/works/10.1002%2FJCC.24030

Systematic benchmarking of large molecular dynamics simulations employing GROMACS on massive multiprocessing facilities

21 January 2018

1 reference

PubMed

https://pubmed.ncbi.nlm.nih.gov/26238484

inferred from PubMed ID database lookup

12 December 2020

based on heuristic

Identifiers

DOI

10.1002/JCC.24030

1 reference

journals/jcc/KutznerPFEGG15

28 September 2017

1 reference

1 reference

DBLP Dataset 2021-01-02

28 January 2021

0 references

1 reference

28 September 2017

PubMed publication ID

26238484

1 reference