When.com Web Search

  1. Ads

    related to: molecular kit elements to build a website

Search results

  1. Results From The WOW.Com Content Network
  2. List of cheminformatics toolkits - Wikipedia

    en.wikipedia.org/wiki/List_of_Cheminformatics...

    Assemble molecules from elements or submolecules. Apply reactions on input reactant structures, resulting in output of reaction product structures. Generate molecular fingerprints. Fingerprints are bit-vectors where individual bits correspond to the presence or absence of structural features.

  3. Comparison of software for molecular mechanics modeling

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

    High performance GPU-accelerated ab initio molecular dynamics and TD/DFT software package for very large molecular or even nanoscale systems. Runs on NVIDIA GPUs and 64-bit Linux, has heavily optimized CUDA code. Proprietary, trial licenses available PetaChem LLC: TINKER: I Yes Yes Yes Yes I I Yes Yes Software tools for molecular design-Tinker ...

  4. ACD/ChemSketch - Wikipedia

    en.wikipedia.org/wiki/ACD/ChemSketch

    ACD/ChemSketch allows for both basic structure drawing and importation of 3D and 2D .MDL files from other molecular modelling programs. ChemSketch has been favorably compared to other molecular modelling software, especially ChemDraw, based on its ability to display a wide range of structural components and the ease of creating complex structures quickly.

  5. Molecular model - Wikipedia

    en.wikipedia.org/wiki/Molecular_model

    The plastic is white and can be painted to distinguish between O and N atoms. Hydrogen atoms are normally implicit and modelled by snipping off the spokes. A model of a typical protein with approximately 300 residues could take a month to build. It was common for laboratories to build a model for each protein solved.

  6. Coot (software) - Wikipedia

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

    The CCP4mg molecular graphics software [9] [10] from Collaborative Computational Project Number 4 is a related project with which Coot shares some code. The projects are focused on slightly different problems, with CCP4mg dealing with presentation graphics and movies, whereas Coot deals with model building and validation.

  7. List of software for nanostructures modeling - Wikipedia

    en.wikipedia.org/wiki/List_of_software_for...

    Three dimensional molecular model of an all-carbon tubular fullerene. This is a list of notable computer programs that are used to model nanostructures at the levels of classical mechanics [1] and quantum mechanics. Furiousatoms [2] - a powerful software for molecular modelling and visualization; Aionics.io [3] - a powerful platform for ...

  1. Ads

    related to: molecular kit elements to build a website