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citpy

citpy is abbrevation of "Chem Is Try in Python"

[ Initially, this program is just for adding smiles syntax (of chemical formula) extension of python ] this project is with great ideal, but with less effort.

data base

  • subatom data
  • atom/isotop data
  • molecule data
  • crystal data
  • big molecule (dna, rna) data

objects

  • objm: point, lattice, point_group etc.
  • objp: electron, neutron, proton, phenon, fermi, boson, atom, functional_group, molecule, dna, rna
  • objc: atom_c, molecule_c, formula( structure_formula, chemical_equation )
  • objb: dna_b, rna_b, etc.

sub models

  • chemg: general chemistry
  • chemi: inorganic chemistry
  • chemo: organic chemistry
  • chems: structure chemistry
  • chemp: physics chemistry
  • chemt: theory chemistry (quantum chemistry)
  • cheml: lab chemistry
  • chemb: bio-chemistry

interface

  • ifmath: to mathematics
  • ifphys: to physics (quantum and statistic)
  • ifbio : to biology

format translator

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chemical formula extension of python

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