Evidence map›Paper›PMID 30084079›Full record

ArticleJournal of computer-aided molecular design2018

HTMoL: full-stack solution for remote access, visualization, and analysis of molecular dynamics trajectory data.

Mauricio Carrillo-Tripp, Leonardo Alvarez-Rivera, Omar Israel Lara-Ramírez, Francisco Javier Becerra-Toledo, Adan Vega-Ramírez, Emmanuel Quijas-Valades, Eduardo González-Zavala, Julio Cesar González-Vázquez, Javier García-Vieyra, Nelly Beatriz Santoyo-Rivera and 2 more

Abstract read
PubMed Publisher
In one paragraph

Article in Journal of computer-aided molecular design, 2018. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 6 papers.

0numbers the graph read from it
0cells of the map it votes in
6citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

6 citing papers in PubMed.

  1. Review
  2. Article
  3. High-performance macromolecular data delivery and visualization for the web.Acta crystallographica. Section D, Structural biology · 2020
    Article
  4. How Do Molecular Dynamics Data Complement Static Structural Data of GPCRs.International journal of molecular sciences · 2020
    Review
  5. Article
  6. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

12 authors.

Mauricio Carrillo-TrippBiomolecular Diversity Lab, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional Unidad Monterrey, Vía del Conocimiento 201, Parque de Investigación e Innovación Tecnológica., C.P. 66600, Apodaca, Nuevo León, México. mauricio.carrillo@cinvestav.mx.ORCID 0000-0003-0060-6486
Leonardo Alvarez-RiveraIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Omar Israel Lara-RamírezDepartamento de Computación, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional, Ciudad de México, México.
Francisco Javier Becerra-ToledoIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Adan Vega-RamírezIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Emmanuel Quijas-ValadesIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Eduardo González-ZavalaIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Julio Cesar González-VázquezIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Javier García-VieyraDepartamento de Computación, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional, Ciudad de México, México.
Nelly Beatriz Santoyo-RiveraIngeniería en Sistemas, Instituto Tecnológico Superior de Irapuato, Irapuato, Guanajuato, México.
Sergio Victor Chapa-VergaraDepartamento de Computación, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional, Ciudad de México, México.
Amilcar Meneses-ViverosDepartamento de Computación, Centro de Investigación y de Estudios Avanzados del Instituto Politécnico Nacional, Ciudad de México, México.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

Research on biology has seen significant advances with the use of molecular dynamics (MD) simulations. The MD methodology enables explanation and discovery of molecular mechanisms in a wide range of natural processes and biological systems. The need to readily share the ever-increasing amount of MD data has been hindered by the lack of specialized bioinformatic tools. The difficulty lies in the efficient management of the data, i.e., in sending and processing 3D information for its visualization. In this work, we present HTMoL, a plug-in-free, secure GPU-accelerated web application specifically designed to stream and visualize MD trajectory data on a web browser. Now, individual research labs can publish MD data on the Internet, or use HTMoL to profoundly improve scientific reports by including supplemental MD data in a journal publication. HTMoL can also be used as a visualization interface to access MD trajectories generated on a high-performance computer center directly. Furthermore, the HTMoL architecture can be leveraged with educational efforts to improve learning in the fields of biology, chemistry, and physics.

Indexed as

Molecular Dynamics SimulationInternetLignansProtein ConformationProteinsSoftwareThermodynamicsUser-Computer InterfaceLignansProteinsData publishingData sharingData streamingGraphical processing unitInteractive dynamicsInteractive structureWeb applicationWebgl

Identifiers

What OpenQuestion holds

Textmetadata
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.