David S Palmer

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	Wszystkie	Od 2020
Cytowania	3442	1981
h-indeks	30	23
i10-indeks	50	40

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Matthew J BakerChief Technical Officer, Dxcover Ltd & Professor of Early Diagnostics, University of CentralZweryfikowany adres z uclan.ac.uk
Holly J ButlerHead of Product Development, Dxcover LtdZweryfikowany adres z dxcover.com
Paul M BrennanProfessor of Clinical and Experimental Neurosurgery, Honorary Consultant NeurosurgeonZweryfikowany adres z ed.ac.uk
John MitchellReader in Chemistry, University of St AndrewsZweryfikowany adres z st-andrews.ac.uk
Andrey FrolovComputational chemist at AstraZeneca, Cardiovascular, Renal and Metabolism, BioPharmaceuticals R&DZweryfikowany adres z astrazeneca.com
Maksim MisinZweryfikowany adres z gosupersimple.com
Antonio LlinàsRIA iMed AstraZenecaZweryfikowany adres z astrazeneca.com
Ewan GrayVisiting Research Fellow, University of EdinburghZweryfikowany adres z ed.ac.uk
Birgit SchiøttProfessor of Chemistry, Aarhus UniversityZweryfikowany adres z chem.au.dk
robert c. glenCambridge University and Imperial College LondonZweryfikowany adres z cam.ac.uk
Noel M. O'BoyleComputational Chemist, Nxera Pharma, Cambridge, UKZweryfikowany adres z soseiheptares.com
James L. McDonaghRedx PharmaceuticalsZweryfikowany adres z redxpharma.com
Frank JensenUniversity of AarhusZweryfikowany adres z chem.au.dk
Florian NigschDirector Data Science, Novartis Institutes for BioMedical ResearchZweryfikowany adres z flo.nigsch.com
Tanja van MourikReader, School of Chemistry, University of St AndrewsZweryfikowany adres z st-andrews.ac.uk
Laura D. HughesScripps Research InstituteZweryfikowany adres z scripps.edu
Jonathan M GoodmanProfessor of Chemistry, University of CambridgeZweryfikowany adres z cam.ac.uk
Graeme M. DayProfessor of Chemical Modelling, University of SouthamptonZweryfikowany adres z soton.ac.uk
Ola EngkvistAstraZeneca R&D Gothenburg Orcid:0000-0003-4970-6461Zweryfikowany adres z astrazeneca.com
Peter WillettEmeritus professor, University of SheffieldZweryfikowany adres z sheffield.ac.uk

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David S Palmer

University of Strathclyde || Dxcover Ltd

Zweryfikowany adres z strath.ac.uk - Strona główna

Computational chemistry biochemistry physics cheminformatics cancer diagnostics


Tytuł Sortuj wg cytatów Sortuj wg roku Sortuj wg tytułu	Cytowane przez Cytowane przez	Rok
Random forest models to predict aqueous solubility DS Palmer, NM O'Boyle, RC Glen, JBO Mitchell Journal of chemical information and modeling 47 (1), 150-158, 2007	418	2007
Why are some properties more difficult to predict than others? A study of QSPR models of solubility, melting point, and Log P LD Hughes, DS Palmer, F Nigsch, JBO Mitchell Journal of chemical information and modeling 48 (1), 220-232, 2008	233	2008
Solvation thermodynamics of organic molecules by the molecular integral equation theory: approaching chemical accuracy EL Ratkova, DS Palmer, MV Fedorov Chemical reviews 115 (13), 6312-6356, 2015	209	2015
Development of high-throughput ATR-FTIR technology for rapid triage of brain cancer HJ Butler, PM Brennan, JM Cameron, D Finlayson, MG Hegarty, ... Nature communications 10 (1), 4501, 2019	193	2019
Liquid biopsies: the future of cancer early detection S Connal, JM Cameron, A Sala, PM Brennan, DS Palmer, JD Palmer, ... Journal of translational medicine 21 (1), 118, 2023	192	2023
Towards a universal method for calculating hydration free energies: a 3D referenceinteraction site model with partial molar volume correction DS Palmer, AI Frolov, EL Ratkova, MV Fedorov Journal of Physics: Condensed Matter 22 (49), 492101, 2010	170	2010
Predicting intrinsic aqueous solubility by a thermodynamic cycle DS Palmer, A Llinàs, I Morao, GM Day, JM Goodman, RC Glen, ... Mol Pharmaceutics, 2008, 5, 266 279, 2008	136*	2008
Is experimental data quality the limiting factor in predicting the aqueous solubility of druglike molecules? DS Palmer, JBO Mitchell Molecular Pharmaceutics 11 (8), 2962-2972, 2014	129	2014
First-principles calculation of the intrinsic aqueous solubility of crystalline druglike molecules DS Palmer, JL McDonagh, JBO Mitchell, T van Mourik, MV Fedorov Journal of chemical theory and computation 8 (9), 3322-3337, 2012	102	2012
Biofluid Spectroscopic Disease Diagnostics: A Review on the Processes and Spectral Impact of Drying JM Cameron, HJ Butler, DS Palmer, MJ Baker Journal of Biophotonics, 2018	101	2018
Exploring ligand stability in protein crystal structures using binding pose metadynamics L Fusani, DS Palmer, DO Somers, ID Wall Journal of Chemical Information and Modeling 60 (3), 1528-1539, 2020	97	2020
Hydration free energies of molecular ions from theory and simulation M Misin, MV Fedorov, DS Palmer The Journal of Physical Chemistry B 120 (5), 975-983, 2016	83	2016
Communication: Accurate hydration free energies at a wide range of temperatures from 3D-RISM M Misin, MV Fedorov, DS Palmer The Journal of Chemical Physics 142 (9), 2015	78	2015
Hydration thermodynamics using the reference interaction site model: speed or accuracy? AI Frolov, EL Ratkova, DS Palmer, MV Fedorov The Journal of Physical Chemistry B 115 (19), 6011-6022, 2011	71	2011
Sequence-dependent DNA structure: a database of octamer structural parameters EJ Gardiner, CA Hunter, MJ Packer, DS Palmer, P Willett Journal of molecular biology 332 (5), 1025-1035, 2003	71	2003
Accurate calculations of the hydration free energies of druglike molecules using the reference interaction site model DS Palmer, VP Sergiievskyi, F Jensen, MV Fedorov The Journal of chemical physics 133 (4), 2010	67	2010
Optimised spectral pre-processing for discrimination of biofluids via ATR-FTIR spectroscopy HJ Butler, BR Smith, R Fritzsch, P Radhakrishnan, DS Palmer, MJ Baker Analyst 143 (24), 6121-6134, 2018	66	2018
Combining Random Forest and 2D Correlation Analysis to Identify Serum Spectral Signatures for Neurooncology BR Smith, KM Ashton, A Brodbelt, TP Dawson, MD Jenkinson, N Hunt, ... Analyst, 2016	64	2016
Health economic evaluation of a serum-based blood test for brain tumour diagnosis: exploration of two clinical scenarios E Gray, HJ Butler, R Board, PM Brennan, AJ Chalmers, T Dawson, ... BMJ open 8 (5), e017593, 2018	59	2018
Developing Infrared Spectroscopic Detection for Stratifying Brain Tumour Patients: Glioblastoma Multiforme vs. Lymphoma MJB James M Cameron, Holly J Butler, Benjamin R Smith, Mark G Hegarty ... Analyst, 2019	53	2019

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