Chemical blogspace - Books & Papers

Effect of Complex-Valued Optimal Orbitals on Atomization Energies with the Perdew-Zunger Self-Interaction Correction to Density Functional Theory.

linked to by 1 published by J Chem Theory Comput on Wed 10th Aug 16

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Complex Orbitals, Multiple Local Minima, and Symmetry Breaking in Perdew-Zunger Self-Interaction Corrected Density Functional Theory Calculations.

linked to by 1 published by J Chem Theory Comput on Tue 12th Jul 16

density functional theory bowler water comments nmr baran reproducible with optimization blog syn depth-first pipeline process optimization business humor petroleum recycling polyester polymerization off topic blogging polypropylene pp pet packaging bpa polycarbonate ocean plastic plastics biopolymers teaching plasticizers pvc academia design misc. dow fire chemistry molding 3-d printing medical devices hdpe polymers polyurethane thermosets sports space crime food safety research patents biology rheology uv curing polyethylene fracking pyrolysis polyoxymethylene art epoxy dupont ldpe pe gyres environment legal education biodegradable pla polylactic acid film silicones testing science health chemicals uv microbeads ketchup abs automotive additives rubber food transportation technical literature journals extrusion heat transfer garbage adhesives kuwait open access polyethylene oxide peo photochemistry accelerated aging pc employment viscosity viscoelasticity crystallization safety self-healing thixotropy non-newtonian mathematics pha bus bits and pieces plastic bags polystyrene vinyl poylvinyl chloride ps glass materials off peer review glass transition mining elastomer peg music tires degradation innovation sulfur polymer crosslinking engineering nylon energy modeling lldpe gpc molecular weight

Interpreting computational neural network QSAR models: a measure of descriptor importance.

linked to by 1 published by J Chem Inf Model on Mon 6th Aug 01

importance descriptor regression research machine learning cheminformatics classification fairness qsar gpcrs sarfari

Direct Spectroscopic Evidence for an n?????* Interaction.

linked to by 1 published by Angew. Chem. Int. Ed. Engl. on Mon 27th Jun 16

bachrach water comments nmr baran reproducible with optimization blog syn depth-first pipeline process optimization business humor petroleum recycling polyester polymerization off topic blogging polypropylene pp pet packaging bpa polycarbonate ocean plastic plastics biopolymers plasticizers pvc academia design misc. dow fire chemistry molding 3-d printing medical devices hdpe polymers polyurethane thermosets sports space crime food safety research patents biology rheology uv curing polyethylene fracking pyrolysis polyoxymethylene art epoxy dupont ldpe pe gyres environment legal education biodegradable pla polylactic acid silicones testing film science health chemicals uv microbeads ketchup abs automotive additives rubber food transportation technical literature journals extrusion heat transfer garbage adhesives kuwait open access polyethylene oxide peo photochemistry accelerated aging pc employment viscosity viscoelasticity crystallization safety self-healing thixotropy non-newtonian mathematics pha bus bits and pieces plastic bags polystyrene vinyl poylvinyl chloride ps glass materials off peer review glass transition mining elastomer peg music tires degradation innovation sulfur polymer crosslinking teaching engineering nylon energy modeling lldpe gpc molecular weight

Redox Switching of Orthoquinone-Containing Aromatic Compounds with Hydrogen and Oxygen Gas.

linked to by 1 published by Angew. Chem. Int. Ed. Engl. on Mon 20th Jun 16

bachrach aromaticity water comments nmr baran reproducible with optimization blog syn depth-first pipeline process optimization business humor petroleum recycling polyester polymerization off topic blogging polypropylene pp pet packaging bpa polycarbonate ocean plastic plastics biopolymers plasticizers pvc academia design misc. dow fire chemistry molding 3-d printing medical devices hdpe polymers polyurethane thermosets sports space crime food safety research patents biology rheology uv curing polyethylene fracking pyrolysis polyoxymethylene art epoxy dupont ldpe pe gyres environment legal education biodegradable pla polylactic acid silicones testing film science health chemicals uv microbeads ketchup abs automotive additives rubber food transportation technical literature journals extrusion heat transfer garbage adhesives kuwait open access polyethylene oxide peo photochemistry accelerated aging pc employment viscosity viscoelasticity crystallization safety self-healing thixotropy non-newtonian mathematics pha bus bits and pieces plastic bags polystyrene vinyl poylvinyl chloride ps glass materials off peer review glass transition mining elastomer peg music tires degradation innovation sulfur polymer crosslinking teaching engineering nylon energy modeling lldpe gpc molecular weight

Why Most Clinical Research Is Not Useful.

linked to by 1 published by PLoS Med. on Wed 1st Jun 16

clinical trial drug development

PPAR Modulating Polyketides from a Chinese Plakortis simplex and Clues on the Origin of Their Chemodiversity.

linked to by 1 published by J. Org. Chem. on Fri 17th Jun 16

nmr bachrach water comments baran reproducible with optimization blog syn depth-first pipeline process optimization business humor petroleum recycling polyester polymerization off topic blogging polypropylene pp pet packaging bpa polycarbonate ocean plastic plastics biopolymers plasticizers pvc academia design misc. dow fire chemistry molding 3-d printing medical devices hdpe polymers polyurethane thermosets sports space crime food safety research patents biology rheology uv curing polyethylene fracking pyrolysis polyoxymethylene art epoxy dupont ldpe pe gyres environment legal education biodegradable pla polylactic acid silicones testing film science health chemicals uv microbeads ketchup abs automotive additives rubber food transportation technical literature journals extrusion heat transfer garbage adhesives kuwait open access polyethylene oxide peo photochemistry accelerated aging pc employment viscosity viscoelasticity crystallization safety self-healing thixotropy non-newtonian mathematics pha bus bits and pieces plastic bags polystyrene vinyl poylvinyl chloride ps glass materials off peer review glass transition mining elastomer peg music tires innovation sulfur polymer crosslinking teaching engineering nylon energy lldpe gpc molecular weight

Beyond DP4: an Improved Probability for the Stereochemical Assignment of Isomeric Compounds using Quantum Chemical Calculations of NMR Shifts.

linked to by 1 published by J. Org. Chem. on Fri 18th Dec 15

nmr bachrach water comments baran reproducible with optimization blog syn depth-first pipeline process optimization business humor petroleum recycling polyester polymerization off topic blogging polypropylene pp pet packaging bpa polycarbonate ocean plastic plastics biopolymers plasticizers pvc academia design misc. dow fire chemistry molding 3-d printing medical devices hdpe polymers polyurethane thermosets sports space crime food safety research patents biology rheology uv curing polyethylene fracking pyrolysis polyoxymethylene art epoxy dupont ldpe pe gyres environment legal education biodegradable pla polylactic acid silicones testing film science health chemicals uv microbeads ketchup abs automotive additives rubber food transportation technical literature journals extrusion heat transfer garbage adhesives kuwait open access polyethylene oxide peo photochemistry accelerated aging pc employment viscosity viscoelasticity crystallization safety self-healing thixotropy non-newtonian mathematics pha bus bits and pieces plastic bags polystyrene vinyl poylvinyl chloride ps glass materials off peer review glass transition mining elastomer peg music tires innovation sulfur polymer crosslinking teaching engineering nylon energy lldpe gpc molecular weight

Brain structure. Cell types in the mouse cortex and hippocampus revealed by single-cell RNA-seq.

linked to by 1 published by Science on Fri 6th Mar 15

clinical trials biological news cancer the central nervous system

Oligodendrocyte heterogeneity in the mouse juvenile and adult central nervous system.

linked to by 1 published by Science on Fri 10th Jun 16

clinical trials biological news cancer the central nervous system

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