Probabilistic prediction of contacts in protein-ligand complexes.

We introduce a statistical method for evaluating atomic level 3D interaction patterns of protein-ligand contacts. Such patterns can be used for fast separation of likely ligand and ligand binding site combinations out of all those that are geometrically possible. The practical purpose of this probabilistic method is for molecular docking and scoring, as an essential part of a scoring function.

Vertical distribution of sediment enzyme activities involved in the cycling of carbon, nitrogen, phosphorus and sulphur in three boreal rural lakes.

Vertical distribution of eleven hydrolytic enzyme activities were investigated with fluorogenic model substrates in boreal rural lake sediments, Lake Uurainen (13 km(2)), Lake Jämijärvi (9 km(2)) and Lake Pyylampi (0.068 km(2)), in Finland. The eleven hydrolytic enzyme activities were high into deep sediment layers indicating potential for turnover of organic matter in the permanently anoxic zones.

Sediment accumulation of organic halogens in pristine forest lakes: Tracking of a single defined discharge of pulp bleaching wastewater.

Sediment accumulation of organic halogen was studied in two forest lakes, one pristine and one which received 30 m(3) of biologically purified bleaching wastewater from a kraft pulp mill in 1979 equivalent to ca. 2 kg of adsorbable organic halogen (AOX). Lake sediments were dated with(210)Pb,(134)Cs and(137)Cs and the annual deposition rates of organic halogens and organic matter were calculated.

Anaerobic fluidised bed for the purification of effluents from chemical and mechanical pulping.

Anaerobic treatment has seldom been used for wastewaters from the pulp and paper industry and other branches of the chemical industry. Escape of volatile pollutants to the atmosphere, which always occurs during aerobic treatment, is avoided, and much less sludge is being produced than in an aerobic process. The greatest obstacle for using anaerobic treatment in the pulp and paper industry is the large wastewater volume, which necessitates short hydraulic detention times, because the treatment is to occur in an enclosed space.