Software as a bridge between theory and practice in life cycle assessment

Three mutually dependent elements are required for the application of life cycle assessment: methodology, data and software. Obviously, the design of software is determined by the methodology and the type of data available. Conversely, the development of software dictates the way in which data should be collected and recorded, and improves the theoretical framework, as it forces one to state the principles clearly and unambiguously. The influence of the development of software on both data and methodology is addressed and illustrated by examples, with reference to two key terms: transparency and explicitness. Three types of influence are distinguished: the design of a protocol, the formulation in terms of recipes, and the presentation of data.     

Quantification of human amniotic fluid constituents by high resolution proton nuclear magnetic resonance (NMR) spectroscopy

We have investigated the ability of high-resolution proton NMR spectroscopy to provide a biochemical constituent screening of human amniotic fluid (AF). Proton NMR spectra were obtained at 300 MHz on AF from patients undergoing amniocentesis in the mid-trimester. Only AF from normal pregnancies (normal fetal karyotype, normal a-fetoprotein levels, normal birth outcome) was used in this study. The AF supernatant was lyophilized and resuspended in deuterated water containing 0.1 mm phosphate buffer and 6.02 mm disodium maleate. Identification of low molecular weight compounds was confirmed by two-dimensional NMR spectra (primarily correlated spectroscopy, or COSY) and standard addition techniques. A broad profile of compounds were ‘NMR visible’ in a single proton spectrum, including creatinine, glucose, organic acids (acetate, citrate, and lactate) and several amino acids (alanine, histidine, leucine, phenylalanine, tyrosine and valine). The proton spectrum was unaffected by prior freezing/thawing of AF samples. We were able to quantify compounds by comparison with an added concentration standard (maleate) at concentrations as low as 30 μm. Good agreement with literature values based on other analytical techniques was obtained.