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jvsguerra committed Oct 23, 2024
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Expand Up @@ -4,7 +4,7 @@ Welcome to pyKVFinder's documentation!

Welcome to the **Python-C parallel KVFinder (pyKVFinder)** documentation, this page was built to help you get started with our cavity detection and characterization package.

pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities, and provides a comprehensive information regarding their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.
pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities and provides a detailed information about their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.

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<section id="welcome-to-pykvfinder-s-documentation">
<h1>Welcome to pyKVFinder’s documentation!<a class="headerlink" href="#welcome-to-pykvfinder-s-documentation" title="Link to this heading"></a></h1>
<p>Welcome to the <strong>Python-C parallel KVFinder (pyKVFinder)</strong> documentation, this page was built to help you get started with our cavity detection and characterization package.</p>
<p>pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities, and provides a comprehensive information regarding their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.</p>
<p>pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities and provides a detailed information about their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.</p>
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<p class="caption" role="heading"><span class="caption-text">Python Package</span></p>
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Expand Up @@ -4,7 +4,7 @@ Welcome to pyKVFinder's documentation!

Welcome to the **Python-C parallel KVFinder (pyKVFinder)** documentation, this page was built to help you get started with our cavity detection and characterization package.

pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities, and provides a comprehensive information regarding their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.
pyKVFinder is an open-source Python package designed for detecting and characterizing cavities in biomolecular structures. It employs a geometric grid-and-sphere-based method with a dual-probe system to detect cavities and provides a detailed information about their spatial, depth, constitutional, and hydropathy characteristics. In addition to cavity detection, pyKVFinder also estimates the molecular volume, using van der Waals (vdW) surface, solvent excluded surface (SES), and solvent accessible surface (SAS) to represent the molecular surface.

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.. # with overline, for parts
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