Distributions Which Depend on Chemistry-Mol
Release Uploaded
Chemistry-Harmonia-0.118 Decision of simple and difficult chemical puzzles. 18 May 2013 20:01:04 GMT
Chemistry-File-SMILES-0.47 SMILES linear notation parser/writer 08 Jul 2010 03:16:39 GMT
Chemistry-File-PDB-0.23 Protein Data Bank file format reader/writer 10 May 2009 21:58:55 GMT
Chemistry-Ring-0.20 Represent a ring as a substructure of a molecule 10 May 2009 21:14:18 GMT
Chemistry-Pattern-0.27 Chemical substructure pattern matching 10 May 2009 21:00:10 GMT
Chemistry-Canonicalize-0.11 Number the atoms in a molecule in a unique way 10 May 2009 20:17:04 GMT
Chemistry-Bond-Find-0.23 Detect bonds in a molecule from atomic 3D coordinates and assign formal bond orders 10 May 2009 20:05:27 GMT
Chemistry-File-MDLMol-0.21 MDL molfile reader/writer 10 May 2009 19:52:35 GMT
Chemistry-File-InternalCoords-0.03 Internal coordinates (z-matrix) molecule format reader/writer 07 Apr 2007 23:59:47 GMT
Chemistry-File-QChemOut-0.10 Q-Chem ouput molecule format reader 04 Oct 2006 16:20:37 GMT
Chemistry-MidasPattern-0.11 Select atoms in macromolecules 16 May 2005 23:06:55 GMT
Chemistry-File-SMARTS-0.22 SMARTS chemical substructure pattern linear notation parser 16 May 2005 22:22:44 GMT
Chemistry-Mok-0.25 an awk for molecules 16 May 2005 21:55:57 GMT
Chemistry-File-VRML-0.10 Generate VRML models for molecules 16 May 2005 21:17:49 GMT
Chemistry-3DBuilder-0.10 Generate 3D coordinates from a connection table 06 May 2005 22:37:42 GMT
Chemistry-File-SLN-0.11 SLN linear notation parser/writer 29 Mar 2005 16:42:04 GMT
Chemistry-Reaction-0.02 Explicit chemical reactions 26 Sep 2004 19:20:27 GMT
Chemistry-InternalCoords-0.18 Represent the position of an atom using internal coordinates and convert it to Cartesian coordinates. 24 Sep 2004 20:51:39 GMT
Chemistry-FormulaPattern-0.10 Match molecule by formula 11 Aug 2004 23:09:39 GMT
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