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  2. List of protein structure prediction software - Wikipedia

    en.wikipedia.org/wiki/List_of_protein_structure...

    A unified interface for: Tertiary structure prediction/3D modelling, 3D model quality assessment, Intrinsic disorder prediction, Domain prediction, Prediction of protein-ligand binding residues Automated webserver and some downloadable programs RaptorX: remote homology detection, protein 3D modeling, binding site prediction

  3. Swiss-model - Wikipedia

    en.wikipedia.org/wiki/Swiss-model

    Swiss-model (stylized as SWISS-MODEL) is a structural bioinformatics web-server dedicated to homology modeling of 3D protein structures. [1] [2] As of 2024, homology modeling is the most accurate method to generate reliable three-dimensional protein structure models and is routinely used in many practical applications.

  4. List of molecular graphics systems - Wikipedia

    en.wikipedia.org/wiki/List_of_molecular_graphics...

    Free open-source: Java 3D applet or standalone program: Ovito: MM XRD EM MD: Free open-source: Python [13] [14] PyMOL: MM XRD SMI EM: Open-source [15] Python [16] [self-published source?] According to the author, almost 1/4 of all published images of 3D protein structures in the scientific literature were made via PyMOL. [citation needed ...

  5. RaptorX - Wikipedia

    en.wikipedia.org/wiki/RaptorX

    RaptorX is a software and web server for protein structure and function prediction that is free for non-commercial use. RaptorX is among the most popular methods for protein structure prediction. RaptorX is among the most popular methods for protein structure prediction.

  6. Comparison of software for molecular mechanics modeling

    en.wikipedia.org/wiki/Comparison_of_software_for...

    Free open source MIT: OpenMM: Orac: No No Yes Yes No Yes No Yes No Molecular dynamics simulation program to explore free energy surfaces in biomolecular systems at the atomic level Free open source: Orac download page: NAMD + VMD: Yes Yes Yes Yes No Yes I Yes Yes Fast, parallel MD, CUDA Proprietary, free academic use, source code Beckman ...

  7. Molecular Operating Environment - Wikipedia

    en.wikipedia.org/wiki/Molecular_Operating...

    When docking proteins, proteins are obtained from the Protein Data Bank (PDB), which is an online, open access resources containing the classification, structure/folding, organism, sequence length, mutations, genome, sequence, and other data relating to proteins. [11] The structure of a protein can precisely be determined through a process ...

  8. Coot (software) - Wikipedia

    en.wikipedia.org/wiki/Coot_(software)

    Coot can be used to read files containing 3D atomic coordinate models of macromolecular structures in a number of formats, including pdb, mmcif, and Shelx files. The model may then be rotated in 3D and viewed from any viewpoint. The atomic model is represented by default using a stick-model, with vectors representing chemical bonds.

  9. Computer Atlas of Surface Topography of Proteins - Wikipedia

    en.wikipedia.org/wiki/Computer_Atlas_of_Surface...

    The new CASTp now incorporated 3Dmol.js for structural visualization, made users able to browse, to interact the protein 3D model, and to examine the computational results in latest web-browsers including Chrome, Firefox, Safari, et al. Users can pick their own representation style of the atoms which form each topographic feature, and to edit ...