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The Journal of Chemical Physics, ISSN 0021-9606, 04/2019, Volume 150, Issue 15, p. 150901
Journal Article
Clinica Chimica Acta, ISSN 0009-8981, 05/2014, Volume 432, pp. 77 - 81
This paper examines the evolution of External Quality Assessment Schemes (EQAS), focusing on the need for target values based on reference methods and control... 
Traceability | External quality assessment | Accuracy | LABORATORY MEDICINE | PERFORMANCE | CLINICAL-CHEMISTRY | COMMUTABILITY | SERUM | EXPERIENCE | MEDICAL LABORATORY TECHNOLOGY | HARMONIZATION | PRECISION | Reference Standards | Clinical Laboratory Techniques - standards | Humans | Quality Assurance, Health Care - methods | Measuring instruments | Quality management
Journal Article
Clinical Chemistry, ISSN 0009-9147, 05/2012, Volume 58, Issue 5, pp. 808 - 810
  [...]these methods provide no control of preanalytical variables (fasting status, type of tubes, and timing before centrifugation and/or analysis) and no... 
STANDARDIZATION | VALUES | LABORATORY MEDICINE | MEDICAL LABORATORY TECHNOLOGY | Asian Continental Ancestry Group | Humans | European Continental Ancestry Group | Female | Male | Biomarkers - blood | Databases, Factual | Periodical publishing | Services | Children | Research | Health aspects | Pediatrics | Methods | Endorsements
Journal Article
Clinical Biochemistry, ISSN 0009-9120, 07/2018, Volume 57, pp. 37 - 40
Measurement uncertainty (MU) is a “non-negative parameter characterizing the dispersion of the quantity values being attributed to a measurand, based on the... 
Internal Quality Control | Measurement uncertainty | Bias | Imprecision | ERROR | MEDICAL LABORATORY TECHNOLOGY | CLINICAL LABORATORIES | Measurement | Measuring instruments | Quality control | Quality management
Journal Article
Clinical Chemistry and Laboratory Medicine (CCLM), ISSN 1434-6621, 02/2019, Volume 57, Issue 3, pp. 353 - 358
The classical role of the clinical laboratory, seen as the central place where the samples converge and from where the results are distributed, will be... 
laboratory design | disruptive technologies | digital health | QUALITY | ADOPTION | PERFORMANCE SPECIFICATIONS | FUTURE | MEDICAL LABORATORY TECHNOLOGY | MEDICINE | Health care | Medicine | Data management | Laboratories | Health | Technology | Standardization | Big Data | Data processing | New technology | Information technology | Data interpretation
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 06/2018, Volume 148, Issue 23, p. 231102
The curvature dependence of interfacial free energy, which is crucial in quantitatively predicting nucleation kinetics and the stability of bubbles and... 
CHEMISTRY, PHYSICAL | MELT | FREE-ENERGY | PRESSURE TENSOR | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | Equilibrium conditions | Nucleation | Liquid-solid interfaces | Computer simulation | Computation | Dependence | Variations | Surface tension | Curvature | Free energy | Surface energy
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 03/2018, Volume 148, Issue 10, p. 102301
Generalized Langevin Equation (GLE) thermostats have been used very effectively as a tool to manipulate and optimize the sampling of thermodynamic ensembles... 
MECHANICS | NUCLEAR | SPECTROSCOPY | ALGORITHM | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | WATER | Artifacts | Trajectory measurement | Molecular dynamics | Mathematical models | Anharmonicity | Thermostats | Harmonic oscillators | Physics - Chemical Physics
Journal Article
Proceedings of the National Academy of Sciences of the United States of America, ISSN 0027-8424, 8/2011, Volume 108, Issue 32, pp. 13023 - 13028
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 12/2016, Volume 145, Issue 23, p. 234103
The precise description of quantum nuclear fluctuations in atomistic modelling is possible by employing path integral techniques, which involve a considerable... 
DENSITY | STATISTICAL-MECHANICS | PHASE | FACTORIZATION | QUANTUM | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | DYNAMICS | CHEMISTRY, PHYSICAL | SYSTEMS | ALGORITHMS | EFFICIENT | WATER | Operators (mathematics) | Water | Computer simulation | Mathematical analysis | Neural networks | Integrals | Molecular dynamics | Variations | Density functional theory | Physics - Chemical Physics
Journal Article
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 01/2017, Volume 146, Issue 3, p. 034106
Macroscopic theories of nucleation such as classical nucleation theory envision that clusters of the bulk stable phase form inside the bulk metastable phase.... 
CRYSTAL-NUCLEATION | CHEMISTRY, PHYSICAL | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | Atomic force microscopy | Thermodynamic models | Nucleation | Metastable phases | Computer simulation | Molecular dynamics | Macroscopic models | Nuclei
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 04/2019, Volume 150, Issue 15, p. 154110
The applications of machine learning techniques to chemistry and materials science become more numerous by the day. The main challenge is to devise... 
CHEMISTRY, PHYSICAL | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | Organic chemistry | Correlation | Spatial distribution | Basis functions | Machine learning | Orthogonal functions | Materials science | Representations | Atomic structure | Density | Artificial intelligence
Journal Article