Snails In Silico: A Review of Computational Studies on the Conopeptides.

Mansbach, Rachael A; Travers, Timothy; McMahon, Benjamin H; Fair, Jeanne M; Gnanakaran, S

Mansbach, Rachael A; Travers, Timothy; McMahon, Benjamin H; Fair, Jeanne M; Gnanakaran, S.

Affiliation

Mansbach RA; Theoretical Biology and Biophysics Group, Los Alamos National Laboratory, Los Alamos, NM 87545, USA. mansbach@lanl.gov.
Travers T; Theoretical Biology and Biophysics Group, Los Alamos National Laboratory, Los Alamos, NM 87545, USA. tstravers@lanl.gov.
McMahon BH; Center for Nonlinear Studies, Los Alamos National Laboratory, Los Alamos, NM 87545, USA. tstravers@lanl.gov.
Fair JM; Theoretical Biology and Biophysics Group, Los Alamos National Laboratory, Los Alamos, NM 87545, USA. mcmahon@lanl.gov.
Gnanakaran S; Biosecurity and Public Health Group, Los Alamos National Laboratory, Los Alamos, NM 87545, USA. jmfair@lanl.gov.

Mar Drugs ; 17(3)2019 Mar 01.

Article in En | MEDLINE | ID: mdl-30832207

Subject(s)

Conotoxins/chemistry; Conus Snail/chemistry; Drug Design; Ion Channels/antagonists & inhibitors; Amino Acid Sequence/genetics; Animals; Computer Simulation; Conotoxins/genetics; Conotoxins/pharmacology; Conotoxins/toxicity; Conus Snail/genetics; High-Throughput Screening Assays/methods; Machine Learning; Models, Molecular; Protein Processing, Post-Translational; Protein Structure, Quaternary; Structure-Activity Relationship; Transcriptome/genetics

Key words

computational studies; conopeptides; conotoxins; docking; drug design; ion channels; machine learning; molecular dynamics; review

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Drug Design / Conotoxins / Conus Snail / Ion Channels Type of study: Prognostic_studies Limits: Animals Language: En Journal: Mar Drugs Journal subject: BIOLOGIA / FARMACOLOGIA Year: 2019 Type: Article Affiliation country: United States

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