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ORCIDRoger A. Sayle
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2020 – today
- 2023
[j22]Roger A. Sayle:
Los Alamos chess game 2 (after P-K3) is solved; black wins in 21 moves. J. Int. Comput. Games Assoc. 45(4): 92-101 (2023)- 2020
- [j21]John J. Irwin
, Khanh G. Tang, Jennifer Young, Chinzorig Dandarchuluun, Benjamin R. Wong, Munkhzul Khurelbaatar, Yurii S. Moroz, John W. Mayfield, Roger A. Sayle:
ZINC20 - A Free Ultralarge-Scale Chemical Database for Ligand Discovery. J. Chem. Inf. Model. 60(12): 6065-6073 (2020)
2010 – 2019
- 2017
- [j20]John W. Mayfield, Roger A. Sayle:
Technical implications of new IUPAC elements in cheminformatics. J. Cheminformatics 9(1): 10:1-10:3 (2017) - 2016
- [j19]Daniel M. Lowe, Noel M. O'Boyle, Roger A. Sayle:
Efficient chemical-disease identification and relationship extraction using Wikipedia to improve recall. Database J. Biol. Databases Curation 2016 (2016) - [j18]Noel M. O'Boyle, Roger A. Sayle:
Comparing structural fingerprints using a literature-based similarity benchmark. J. Cheminformatics 8(1): 36:1-36:14 (2016) - 2015
- [j17]Martin Krallinger, Obdulia Rabal, Florian Leitner, Miguel Vazquez, David Salgado, Zhiyong Lu, Robert Leaman, Yanan Lu, Donghong Ji, Daniel M. Lowe, Roger A. Sayle, Riza Theresa Batista-Navarro, Rafal Rak, Torsten Huber, Tim Rocktäschel, Sérgio Matos, David Campos, Buzhou Tang, Hua Xu, Tsendsuren Munkhdalai, Keun Ho Ryu, S. V. Ramanan, P. Senthil Nathan, Slavko Zitnik, Marko Bajec, Lutz Weber, Matthias Irmer, Saber A. Akhondi, Jan A. Kors, Shuo Xu, Xin An, Utpal Kumar Sikdar, Asif Ekbal, Masaharu Yoshioka, Thaer M. Dieb, Miji Choi, Karin Verspoor, Madian Khabsa, C. Lee Giles, Hongfang Liu, Ravikumar Komandur Elayavilli, Andre Lamurias, Francisco M. Couto, Hong-Jie Dai, Richard Tzong-Han Tsai, Caglar Ata, Tolga Can, Anabel Usie, Rui Alves, Isabel Segura-Bedmar, Paloma Martínez, Julen Oyarzabal, Alfonso Valencia:
The CHEMDNER corpus of chemicals and drugs and its annotation principles. J. Cheminformatics 7(S-1): S2 (2015) - [j16]Daniel M. Lowe, Roger A. Sayle:
LeadMine: a grammar and dictionary driven approach to entity recognition. J. Cheminformatics 7(S-1): S5 (2015) - [j15]Nadine Schneider, Daniel M. Lowe, Roger A. Sayle, Gregory A. Landrum:
Development of a Novel Fingerprint for Chemical Reactions and Its Application to Large-Scale Reaction Classification and Similarity. J. Chem. Inf. Model. 55(1): 39-53 (2015) - [j14]Nadine Schneider, Daniel M. Lowe, Roger A. Sayle, Gregory A. Landrum:
Corrections to "Development of a Novel Fingerprint for Chemical Reactions and Its Application to Large-Scale Reaction Classification and Similarity". J. Chem. Inf. Model. 55(2): 474 (2015) - [j13]Nadine Schneider, Roger A. Sayle, Gregory A. Landrum:
Get Your Atoms in Order - An Open-Source Implementation of a Novel and Robust Molecular Canonicalization Algorithm. J. Chem. Inf. Model. 55(10): 2111-2120 (2015) - 2014
- [j12]Noel M. O'Boyle, Roger A. Sayle, Jonas Boström:
What compound should I make next? Using Matched Molecular Series for prospective medicinal chemistry. J. Cheminformatics 6(S-1): 5 (2014) - 2013
- [j11]Roger A. Sayle, José Batista, J. Andrew Grant:
Efficient maximum common subgraph (MCS) searching of large chemical databases. J. Cheminformatics 5(S-1): 15 (2013) - 2012
- [j10]Roger A. Sayle, Paul Hongxing Xie, Sorel Muresan:
Improved Chemical Text Mining of Patents with Infinite Dictionaries and Automatic Spelling Correction. J. Chem. Inf. Model. 52(1): 51-62 (2012) - 2011
- [j9]Roger A. Sayle, Plamen Petrov, Jon Winter, Sorel Muresan:
Improved chemical text mining of patents using infinite dictionaries, translation and automatic spelling correction. J. Cheminformatics 3(S-1): 16 (2011) - 2010
- [j8]Roger A. Sayle:
So you think you understand tautomerism? J. Comput. Aided Mol. Des. 24(6-7): 485-496 (2010)
2000 – 2009
- 2009
- [j7]Roger A. Sayle:
Foreign Language Translation of Chemical Nomenclature by Computer. J. Chem. Inf. Model. 49(3): 519-530 (2009) - 2006
- [j6]Roger A. Sayle, Anthony Nicholls:
Electrostatic evaluation of isosteric analogues. J. Comput. Aided Mol. Des. 20(4): 191-208 (2006) - [j5]J. Andrew Grant, James A. Haigh, Barry T. Pickup, Anthony Nicholls, Roger A. Sayle:
Lingos, Finite State Machines, and Fast Similarity Searching. J. Chem. Inf. Model. 46(5): 1912-1918 (2006) - 2003
- [c1]B. Magnanti, Anthony Nicholls, Roger A. Sayle:
Multi-Platform Skeletal Visualisation and Reproduction in Stereolithography. VAST 2003: 89-92
1990 – 1999
- 1998
- [j4]Steve Taylor, T. Charles Hodgman, Chris B. Littler, Roger A. Sayle, Robert W. Gill, Marcus D. Oxer, C. H. O'Donnell, Andrew Lyall:
Automated management of gene discovery projects. Bioinform. 14(2): 217-218 (1998) - 1997
- [j3]Ross D. King, Mansoor A. S. Saqi, Roger A. Sayle, Michael J. E. Sternberg:
DSC: public domain protein secondary structure predication. Comput. Appl. Biosci. 13(4): 473-474 (1997) - 1995
- [j2]Roger A. Sayle, Mansoor A. S. Saqi, M. Weir, Andrew Lyall:
PdbAlign, PdbDist and DistAlign: tools to aid in relating sequence variability to structure. Comput. Appl. Biosci. 11(5): 571-573 (1995) - 1994
- [j1]Mansoor A. S. Saqi, Roger A. Sayle:
PdbMotif--a tool for the automatic identification and display of motifs in protein structures. Comput. Appl. Biosci. 10(5): 545-546 (1994)
Coauthor Index
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