Zobrazeno 1 - 10
of 100
pro vyhledávání: '"Richard A. Sykes"'
Autor:
William R. Pitt, Alicia P. Higueruelo, Chris J Radoux, Anthony R. Bradley, David R. Spring, Mihaela D. Smilova, Tom L. Blundell, Richard A. Sykes, Andrew R. Leach, Brian D. Marsden, Jason C. Cole, Peter Richard Curran
Methods that survey protein surfaces for binding hotspots can help to evaluate target tractability and guide exploration of potential ligand binding regions. Fragment Hotspot Maps builds upon interaction data mined from the CSD (Cambridge Structural
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a21861b71a8b52ec26df80485edbf150
https://www.repository.cam.ac.uk/handle/1810/304045
https://www.repository.cam.ac.uk/handle/1810/304045
Publikováno v:
CrystEngComm. 20:2698-2704
With the aim to develop simple, programmatically generated, topology-based descriptors of crystal structures for application to mechanical properties prediction methods, we have developed a new geometric analysis protocol using the CSD Python API. By
Publikováno v:
IEEE Transactions on Control Systems Technology. 24:979-991
This paper presents a novel automotive engine management system (EMS) calibration methodology for rapid dynamometer test-bed data collection and mapping I.C. engine controllers with significant dynamic and transient performance requirements. This pap
Autor:
Jason C. Cole, Alicia P. Higueruelo, Chris J Radoux, William R. Pitt, Mihaela D. Smilova, Anthony R. Bradley, Richard A. Sykes, Peter Richard Curran, Tom L. Blundell, David R. Spring
Publikováno v:
Acta Crystallographica Section A Foundations and Advances. 75:a225-a225
Publikováno v:
Acta Crystallographica Section A Foundations and Advances. 74:e341-e341
Publikováno v:
Opflow. 35:12-17
Autor:
Richard Dodgson Sykes
Publikováno v:
Journal of Psychosomatic Research. 60:341-344
Objective: To examine analytically the question of whether the characterization of somatoform disorders (SFDs) in Diagnostic and Statistical Manual, Fourth Edition (DSM-IV) provides adequate grounds for classifying them as mental disorders rather tha
Publikováno v:
Journal of Chemical Information and Computer Sciences. 39:846-860
The selection and modification of atoms or functional groups underly many of the manipulations central to molecular modeling. It has become even more important to automate these tasks with the current prevalence of work with large databases of molecu
Autor:
Michael A. Firth, David R. Westhead, Timothy R. Auton, Bohdan Waszkowycz, Jin Li, Richard A. Sykes, Stephen Clinton Young, David E. Clark, Christopher W. Murray
Publikováno v:
Journal of Computer-Aided Molecular Design. 11:193-207
This paper describes a novel methodology, PRO_SELECT, which combines elements of structure-based drug design and combinatorial chemistry to create a new paradigm for accelerated lead discovery. Starting with a synthetically accessible template positi
Publikováno v:
Journal of Computer-Aided Molecular Design. 10:397-416
Two new computational tools, PRO_PHARMEX and PRO_SCOPE, for use in active-site-directed searching of 3D databases are described. PRO_PHARMEX is a flexible, graphics-based program facilitating the extraction of pharmacophores from the active site of a