The FAIR Guiding Principles for scientific data management and stewardship MD Wilkinson, M Dumontier, IJJ Aalbersberg, G Appleton, M Axton, ... Scientific data 3 (1), 1-9, 2016 | 14386 | 2016 |
Errors in protein structures RWW Hooft, G Vriend, C Sander, EE Abola Nature 381, 272, 1996 | 2691 | 1996 |
Determination of absolute structure using Bayesian statistics on Bijvoet differences RWW Hooft, LH Straver, AL Spek Journal of Applied Crystallography 41 (1), 96-103, 2008 | 890 | 2008 |
A series of PDB related databases for everyday needs RP Joosten, TAH Te Beek, E Krieger, ML Hekkelman, RWW Hooft, ... Nucleic acids research 39 (suppl_1), D411-D419, 2010 | 877 | 2010 |
PRODRG, a program for generating molecular topologies and unique molecular descriptors from coordinates of small molecules DMF Van Aalten, R Bywater, JBC Findlay, M Hendlich, RWW Hooft, ... Journal of computer-aided molecular design 10, 255-262, 1996 | 786 | 1996 |
Positioning hydrogen atoms by optimizing hydrogen‐bond networks in protein structures RWW Hooft, C Sander, G Vriend Proteins: Structure, Function, and Bioinformatics 26 (4), 363-376, 1996 | 381 | 1996 |
Objectively judging the quality of a protein structure from a Ramachandran plot RWW Hooft, C Sander, G Vriend Bioinformatics 13 (4), 425-430, 1997 | 372 | 1997 |
Accurate cells from area-detector images AJM Duisenberg, R Hooft, AMM Schreurs, J Kroon Journal of applied crystallography 33 (3), 893-898, 2000 | 327 | 2000 |
FAIR principles: interpretations and implementation considerations A Jacobsen, R de Miranda Azevedo, N Juty, D Batista, S Coles, R Cornet, ... Data intelligence 2 (1-2), 10-29, 2020 | 285 | 2020 |
Assignment of Protonation States in Proteins and Ligands: Combining pKa Prediction with Hydrogen Bonding Network Optimization E Krieger, RL Dunbrack, RWW Hooft, B Krieger Computational drug discovery and design, 405-421, 2012 | 264 | 2012 |
The use of position‐specific rotamers in model building by homology G Chinea, G Padrón, RWW Hooft, C Sander, G Vriend Proteins: Structure, Function, and Bioinformatics 23 (3), 415-421, 1995 | 179 | 1995 |
An adaptive umbrella sampling procedure in conformational analysis using molecular dynamics and its application to glycol RWW Hooft, BP van Eijck, J Kroon The Journal of chemical physics 97 (9), 6690-6694, 1992 | 179 | 1992 |
The PDBFINDER database: a summary of PDB, DSSP and HSSP information with added value RWW Hooft, C Sander, M Scharf, G Vriend Bioinformatics 12 (6), 525-529, 1996 | 174 | 1996 |
The value of data B Mons, H van Haagen, C Chichester, PB Hoen, JT den Dunnen, ... Nature genetics 43 (4), 281-283, 2011 | 166 | 2011 |
Improving macromolecular electrostatics calculations JE Nielsen, KV Andersen, B Honig, RWW Hooft, G Klebe, G Vriend, ... Protein engineering 12 (8), 657-662, 1999 | 142 | 1999 |
Four simple recommendations to encourage best practices in research software RC Jiménez, M Kuzak, M Alhamdoosh, M Barker, B Batut, M Borg, ... F1000Research 6, 2017 | 134 | 2017 |
Using the t-distribution to improve the absolute structure assignment with likelihood calculations RWW Hooft, LH Straver, AL Spek Journal of applied crystallography 43 (4), 665-668, 2010 | 123 | 2010 |
Verification of protein structures: side-chain planarity RWW Hooft, C Sander, G Vriend Journal of Applied Crystallography 29 (6), 714-716, 1996 | 121 | 1996 |
Who checks the checkers? Four validation tools applied to eight atomic resolution structures KS Wilson, S Butterworth, Z Dauter, VS Lamzin, M Walsh, S Wodak, ... Journal of Molecular Biology 276 (2), 417-436, 1998 | 120 | 1998 |
Addendum: The FAIR Guiding Principles for scientific data management and stewardship MD Wilkinson, M Dumontier, I Jan Aalbersberg, G Appleton, M Axton, ... Scientific data 6 (1), 6, 2019 | 114 | 2019 |