New Software Links Part 2

• Web based Calculators
• Sheffield ChemPuter Isotope Patterns calculator
• MolE - Molecular Mass Calculator, University of Utah
• Elemental Composition Calculator University of Utah
• ChemCalc calculates the molecular formula, molecular mass, exact mass, elemental analysis and plots the isotopic distribution graph.
• Isotopic distribution by Scientific Instrument Services
• Molecular Mass Calculation at chemie.de
• RasMol is a free program which displays molecular structure
• Chime is the web based brother of rasmol
• Umetrics: Modde, Simca. Nice demo-versions! (experimental design and multivariate data analysis and modeling)
• MultiSimplex: MultiSimplex: a Windows-based software for experimental design and optimization. Free demo!
• vibrationdata.com Not straight chemistry but lot of useful scientific software. The software and tutorials require a username and password. The subscription cost is $24.00
• Infometrix Pirouette a chemometrics modeling software for Windows $4000
• ChemWindow and some free ware
• ChemKey Organic Synthetic Method Computer Database $325
• CompuChem ChemTools and evaluation and demo versions after registration. (No prices)
• Acorn NMR Inc.: Nuts, post-processing of NMR data, shareware
• ChemInnovation Chemistry 4-D Draw, free demo
• SPOT Chemie, Naturwissenschaftliche und technische Software zum Download (übersichtlich, supergut)
• Software links (englisch and german via searchform @chemie.de)
• Software Reviews from the CTI Centre for Chemistry. No download!