Quantitative structure-property relationship modeling of diverse materials properties.
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Stepping into the omics era: Opportunities and challenges for biomaterials science and engineeringHow can Databases assist with the Prediction of Chemical Compounds?Deep learning for computational chemistry.Materials Genome in Action: Identifying the Performance Limits of Physical Hydrogen StorageStalking the Materials Genome: A Data-Driven Approach to the Virtual Design of Nanostructured Polymers.Relationships between chemical structure, mechanical properties and materials processing in nanopatterned organosilicate finsModelling human embryoid body cell adhesion to a combinatorial library of polymer surfaces.Analysis and prediction of defects in UV photo-initiated polymer microarrays.An Experimental and Computational Approach to the Development of ZnO Nanoparticles that are Safe by Design.Developing a Suitable Model for Water Uptake for Biodegradable Polymers Using Small Training Sets.Materials Informatics: Statistical Modeling in Material Science.Engineering serendipity: High-throughput discovery of materials that resist bacterial attachment.Understanding the hydrogen bonds in ionic liquids and their roles in properties and reactions.Toward a systematic exploration of nano-bio interactions.Dynamical descriptors of bioactivity: a correlation between chemical durability and ion migration in biodegradable glasses.Literature Review of (Q)SAR Modelling of Nanomaterial Toxicity.Performance of Deep and Shallow Neural Networks, the Universal Approximation Theorem, Activity Cliffs, and QSAR.Partition coefficients for the SAMPL5 challenge using transfer free energies.Illuminating Flash Point: Comprehensive Prediction Models.Beware of R(2): Simple, Unambiguous Assessment of the Prediction Accuracy of QSAR and QSPR Models.Artificial evolution of coumarin dyes for dye sensitized solar cells.Deep-learning: investigating deep neural networks hyper-parameters and comparison of performance to shallow methods for modeling bioactivity data.Fast and accurate computational modeling of adsorption on graphene: a dispersion interaction challenge.Polymer Informatics: Opportunities and Challenges.Quantitative structure-property relationship modeling of Grätzel solar cell dyes.Biological Surface Adsorption Index of Nanomaterials: Modelling Surface Interactions of Nanomaterials with Biomolecules.A comprehensive QSPR model for dielectric constants of binary solvent mixtures.Image-Based Analysis to Predict the Activity of Tariquidar Analogs as P-Glycoprotein Inhibitors: The Importance of External Validation.Applicability Domains and Consistent Structure Generation.Screening for High Conductivity/Low Viscosity Ionic Liquids Using Product Descriptors.Current challenges in atomistic simulations of glasses for biomedical applications.Unlocking Inter- to Non-Penetrating Frameworks Using Steric Influences on Spacers for CO2 Adsorption.Modelling and Prediction of Bacterial Attachment to PolymersEngineered Nanomaterials: Knowledge Gaps in Fate, Exposure, Toxicity, and Future DirectionsMachine learning meets volcano plots: computational discovery of cross-coupling catalystsBenchmarking support vector regression against partial least squares regression and artificial neural network: Effect of sample size on model performanceInverse quantum chemistry: Concepts and strategies for rational compound designQuantitative structure–property relationship modeling of ruthenium sensitizers for solar cells applications: novel tools for designing promising candidatesAccelerated discovery of stable lead-free hybrid organic-inorganic perovskites via machine learningCommittee machine that votes for similarity between materials
P2860
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P2860
Quantitative structure-property relationship modeling of diverse materials properties.
description
2012 nî lūn-bûn
@nan
2012年の論文
@ja
2012年学术文章
@wuu
2012年学术文章
@zh
2012年学术文章
@zh-cn
2012年学术文章
@zh-hans
2012年学术文章
@zh-my
2012年学术文章
@zh-sg
2012年學術文章
@yue
2012年學術文章
@zh-hant
name
Quantitative structure-property relationship modeling of diverse materials properties.
@en
Quantitative structure-property relationship modeling of diverse materials properties.
@nl
type
label
Quantitative structure-property relationship modeling of diverse materials properties.
@en
Quantitative structure-property relationship modeling of diverse materials properties.
@nl
prefLabel
Quantitative structure-property relationship modeling of diverse materials properties.
@en
Quantitative structure-property relationship modeling of diverse materials properties.
@nl
P50
P356
P1433
P1476
Quantitative structure-property relationship modeling of diverse materials properties
@en
P2093
Frank R Burden
V Chandana Epa
P304
P356
10.1021/CR200066H
P577
2012-01-17T00:00:00Z