Search Results - "Hooft, Rob W.W"
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The road to success: drawing parallels between 'road' and 'research data' infrastructures to foster understanding between service providers, funders and policymakers [version 1; peer review: 2 approved]
Published in F1000 research (2023)“…Background: The work of data research infrastructure operators is poorly understood, yet the services they provide are used by millions of scientists across…”
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2
series of PDB related databases for everyday needs
Published in Nucleic acids research (01-01-2011)“…The Protein Data Bank (PDB) is the world-wide repository of macromolecular structure information. We present a series of databases that run parallel to the…”
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3
FAIR Principles: Interpretations and Implementation Considerations
Published in Data intelligence (01-01-2020)“…The FAIR principles have been widely cited, endorsed and adopted by a broad range of stakeholders since their publication in 2016. By intention, the 15 FAIR…”
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The road to success: drawing parallels between 'road' and 'research data' infrastructures to foster understanding between service providers, funders and policymakers [version 2; peer review: 2 approved]
Published in F1000 research (2023)“…Background: The work of data research infrastructure operators is poorly understood, yet the services they provide are used by millions of scientists across…”
Get full text
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5
Determination of absolute structure using Bayesian statistics on Bijvoet differences
Published in Journal of applied crystallography (01-02-2008)“…A new probabilistic approach is introduced for the determination of the absolute structure of a compound which is known to be enantiopure based on Bijvoet‐pair…”
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Using the t-distribution to improve the absolute structure assignment with likelihood calculations
Published in Journal of applied crystallography (01-08-2010)“…The previously described method for absolute structure determination [Hooft, Straver & Spek (2008). J. Appl. Cryst.41, 96–103] assumes a Gaussian error…”
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7
Bioinformatics in the Netherlands: the value of a nationwide community
Published in Briefings in bioinformatics (22-03-2019)“…Abstract This review provides a historical overview of the inception and development of bioinformatics research in the Netherlands. Rooted in theoretical…”
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Positioning hydrogen atoms by optimizing hydrogen-bond networks in protein structures
Published in Proteins, structure, function, and bioinformatics (01-12-1996)“…A method is presented that positions polar hydrogen atoms in protein structures by optimizing the total hydrogen bond energy. For this goal, an empirical…”
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Objectively judging the quality of a protein structure from a Ramachandran plot
Published in Bioinformatics (01-08-1997)“…Motivation Statistical methods that compare observed and expected distributions of experimental observables provide powerful tools for the quality control of…”
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Probability plots based on Student's t-distribution
Published in Acta crystallographica. Section A, Foundations of crystallography (01-07-2009)“…The validity of the normal distribution as an error model is commonly tested with a (half) normal probability plot. Real data often contain outliers. The use…”
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The Dutch Techcentre for Life Sciences: Enabling data-intensive life science research in the Netherlands
Published in F1000 research (2016)“…We describe the Data programme of the Dutch Techcentre for Life Sciences (DTL, www.dtls.nl). DTL is a new national organisation in scientific research that…”
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Top 10 metrics for life science software good practices [version 1; peer review: 2 approved]
Published in F1000 research (2016)“…Metrics for assessing adoption of good development practices are a useful way to ensure that software is sustainable, reusable and functional…”
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The Dutch Techcentre for Life Sciences: Enabling data-intensive life science research in the Netherlands [version 1; peer review: 3 approved with reservations]
Published in F1000 research (2015)“…We describe a new national organisation in scientific research that facilitates life scientists with technologies and technological expertise in an era where…”
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Crystal Engineering of Melamine-Imide Complexes; Tuning the Stoichiometry by Steric Hindrance of the Imide Carbonyl Groups
Published in Angewandte Chemie International Edition (16-05-1997)“…A defined melamine–imide ratio in cocrystals can be selected by changing the steric hindrance around the hydrogen‐bond acceptor sites of the imides…”
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Molecular dynamics study of conformational and anomeric equilibria in aqueous D-glucose
Published in Journal of physical chemistry (1952) (01-11-1993)Get full text
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The structure of 1,6-diazacyclododecane-7,12-dione, a cyclic monomeric model of polyamide 46
Published in Journal of Crystallographic and Spectroscopic Research (01-12-1993)Get full text
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Improved coordinate reconstruction from stereo diagrams
Published in Journal of molecular graphics (01-06-1996)“…A program has been written that reconstructs three-dimensional coordinates for a protein structure given a stereo C α diagram. Initial three-dimensional…”
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Low-temperature, high-resolution crystal structure study of tricyclo[3.3.1.13,7]decan-2-ol (adamantanol-2)
Published in Journal of Crystallographic and Spectroscopic Research (01-04-1990)Get full text
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