James Platts
James Platts
Reader in Chemistry, Cardiff University
Preverjeni e-poštni naslov na cardiff.ac.uk - Domača stran
Evaluation of human intestinal absorption data and subsequent derivation of a quantitative structure–activity relationship (QSAR) with the Abraham descriptors
YH Zhao, J Le, MH Abraham, A Hersey, PJ Eddershaw, CN Luscombe, ...
Journal of pharmaceutical sciences 90 (6), 749-784, 2001
Estimation of molecular linear free energy relation descriptors using a group contribution approach
JA Platts, D Butina, MH Abraham, A Hersey
Journal of Chemical Information and Computer Sciences 39 (5), 835-845, 1999
Hybrid density functional theory for π‐stacking interactions: Application to benzenes, pyridines, and DNA bases
MP Waller, A Robertazzi, JA Platts, DE Hibbs, PA Williams
Journal of computational chemistry 27 (4), 491-504, 2006
Calculation of intermolecular interactions in the benzene dimer using coupled-cluster and local electron correlation methods
JG Hill, JA Platts, HJ Werner
Physical Chemistry Chemical Physics 8 (35), 4072-4078, 2006
Hydrogen bond structural group constants
MH Abraham, JA Platts
The Journal of organic chemistry 66 (10), 3484-3491, 2001
Directionality of hydrogen bonds to sulfur and oxygen
JA Platts, ST Howard, BRF Bracke
Journal of the American Chemical Society 118 (11), 2726-2733, 1996
Correlation and prediction of a large blood–brain distribution data set—an LFER study
JA Platts, MH Abraham, YH Zhao, A Hersey, L Ijaz, D Butina
European journal of medicinal chemistry 36 (9), 719-730, 2001
Estimation of molecular linear free energy relationship descriptors by a group contribution approach. 2. Prediction of partition coefficients
JA Platts, MH Abraham, D Butina, A Hersey
Journal of Chemical Information and Computer Sciences 40 (1), 71-80, 2000
Spin-component scaling methods for weak and stacking interactions
JG Hill, JA Platts
Journal of Chemical Theory and Computation 3 (1), 80-85, 2007
Fluorine–fluorine interactions in the solid state: an experimental and theoretical study
RJ Baker, PE Colavita, DM Murphy, JA Platts, JD Wallis
The Journal of Physical Chemistry A 116 (5), 1435-1444, 2012
Assessment of the Performance of MP2 and MP2 Variants for the Treatment of Noncovalent Interactions
KE Riley, JA Platts, J Rezac, P Hobza, JG Hill
The Journal of Physical Chemistry A 116 (16), 4159-4169, 2012
Theoretical prediction of hydrogen bond donor capacity
JA Platts
Physical Chemistry Chemical Physics 2 (5), 973-980, 2000
Correlation and estimation of gas–chloroform and water–chloroform partition coefficients by a linear free energy relationship method
MH Abraham, JA Platts, A Hersey, AJ Leo, RW Taft
Journal of pharmaceutical sciences 88 (7), 670-679, 1999
First experimental characterization of a non-nuclear attractor in a dimeric magnesium (I) compound
JA Platts, J Overgaard, C Jones, BB Iversen, A Stasch
The Journal of Physical Chemistry A 115 (2), 194-200, 2011
The RP-HPLC measurement and QSPR analysis of log Po/w values of several Pt (II) complexes
JA Platts, SP Oldfield, MM Reif, A Palmucci, E Gabano, D Osella
Journal of Inorganic Biochemistry 100 (7), 1199-1207, 2006
Calculation of lipophilicity of a large, diverse dataset of anticancer platinum complexes and the relation to cellular uptake
SP Oldfield, MD Hall, JA Platts
Journal of medicinal chemistry 50 (21), 5227-5237, 2007
Theoretical prediction of hydrogen bond basicity
JA Platts
Physical Chemistry Chemical Physics 2 (14), 3115-3120, 2000
The blood-brain barrier and drug delivery to the CNS
DJ Begley, MWB Bradbury, J Kreuter
Marcel Dekker Ltd (Taylor & Francis Ltd), 2000
Calculation of the hydrophobicity of platinum drugs
JA Platts, DE Hibbs, TW Hambley, MD Hall
Journal of Medicinal Chemistry 44 (3), 472-474, 2001
Ab initio studies of proton sponges: 1, 8-bis (dimethylamino) naphthalene
JA Platts, ST Howard, K Wozniak
The Journal of Organic Chemistry 59 (16), 4647-4651, 1994
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