Year |
Citation |
Score |
2018 |
Platts JA, Baker RJ. Non-covalent interactions of uranyl complexes: a theoretical study. Physical Chemistry Chemical Physics : Pccp. PMID 29796550 DOI: 10.1039/C8Cp02444H |
0.304 |
|
2013 |
Platts JA, Hill JG, Riley KE, Řezáč J, Hobza P. Basis Set Dependence of Interaction Energies Computed Using Composite Post-MP2 Methods. Journal of Chemical Theory and Computation. 9: 330-7. PMID 26589036 DOI: 10.1021/Ct300842D |
0.358 |
|
2013 |
Platts JA, Hill JG, Riley KE, ?ezá? J, Hobza P. Basis set dependence of interaction energies computed using composite post-MP2 methods Journal of Chemical Theory and Computation. 9: 330-337. DOI: 10.1021/ct300842d |
0.301 |
|
2012 |
Nguyen TH, Howard ST, Hanrahan JR, Groundwater PW, Platts JA, Hibbs DE. Experimental and theoretical charge density distribution in a host-guest system: synthetic terephthaloyl receptor complexed to adipic acid. The Journal of Physical Chemistry. A. 116: 5618-28. PMID 22548484 DOI: 10.1021/Jp210803M |
0.582 |
|
2012 |
Riley KE, Platts JA, ?ezá? J, Hobza P, Hill JG. Assessment of the performance of MP2 and MP2 variants for the treatment of noncovalent interactions Journal of Physical Chemistry A. 116: 4159-4169. PMID 22475190 DOI: 10.1021/Jp211997B |
0.311 |
|
2010 |
PLATTS JA, HOWARD ST, WOZNIAK K. ChemInform Abstract: Ab initio Studies of Proton Sponges: 1,8-Bis(dimethylamino)naphthalene. Cheminform. 26: no-no. DOI: 10.1002/chin.199506028 |
0.555 |
|
2009 |
Hill JG, Platts JA. Auxiliary Basis Sets for Density-Fitted MP2 Calculations: Correlation-Consistent Basis Sets for the 4d Elements. Journal of Chemical Theory and Computation. 5: 500-505. PMID 26610217 DOI: 10.1021/ct8005584 |
0.33 |
|
2009 |
Gkionis K, Hill JG, Oldfield SP, Platts JA. Performance of Becke's half-and-half functional for non-covalent interactions: energetics, geometries and electron densities. Journal of Molecular Modeling. 15: 1051-60. PMID 19212783 DOI: 10.1007/s00894-009-0459-4 |
0.4 |
|
2008 |
Hill JG, Platts JA. Calculating interaction energies in transition metal complexes with local electron correlation methods. The Journal of Chemical Physics. 129: 134101. PMID 19045072 DOI: 10.1063/1.2982790 |
0.351 |
|
2008 |
Hill JG, Platts JA. Calculating stacking interactions in nucleic acid base-pair steps using spin-component scaling and local second order Møller-Plesset perturbation theory. Physical Chemistry Chemical Physics : Pccp. 10: 2785-91. PMID 18464995 DOI: 10.1039/b718691f |
0.343 |
|
2008 |
Gkionis K, Platts JA, Hill JG. Insights into DNA binding of ruthenium arene complexes: role of hydrogen bonding and pi stacking. Inorganic Chemistry. 47: 3893-902. PMID 18393492 DOI: 10.1021/ic702459h |
0.393 |
|
2008 |
Hill JG, Platts JA. Auxiliary basis sets for density fitting-MP2 calculations: Nonrelativistic triple-zeta all-electron correlation consistent basis sets for the 3d elements Sc-Zn. The Journal of Chemical Physics. 128: 044104. PMID 18247927 DOI: 10.1063/1.2826348 |
0.342 |
|
2007 |
Hill JG, Platts JA. Spin-Component Scaling Methods for Weak and Stacking Interactions. Journal of Chemical Theory and Computation. 3: 80-5. PMID 26627154 DOI: 10.1021/ct6002737 |
0.302 |
|
2006 |
Howard ST, Hibbs DE, Amoroso AJ, Platts JA. Quantum-Chemical Design of Cryptand-like Ditopic Salt Binders. Journal of Chemical Theory and Computation. 2: 354-63. PMID 26626524 DOI: 10.1021/ct050270d |
0.506 |
|
2006 |
Hill JG, Platts JA, Werner HJ. Calculation of intermolecular interactions in the benzene dimer using coupled-cluster and local electron correlation methods. Physical Chemistry Chemical Physics : Pccp. 8: 4072-8. PMID 17028695 DOI: 10.1039/B608623C |
0.368 |
|
2006 |
Waller MP, Howard ST, Platts JA, Piltz RO, Willock DJ, Hibbs DE. Novel properties from experimental charge densities: an application to the zwitterionic neurotransmitter taurine. Chemistry (Weinheim An Der Bergstrasse, Germany). 12: 7603-14. PMID 16927277 DOI: 10.1002/chem.200600392 |
0.564 |
|
2006 |
Howard ST, Hibbs DE, Amoroso AJ, Platts JA. Quantum-chemical design of cryptand-like ditopic salt binders Journal of Chemical Theory and Computation. 2: 354-363. DOI: 10.1021/ct050270d |
0.454 |
|
2001 |
Platts JA, Abraham MH, Zhao YH, Hersey A, Ijaz L, Butina D. Correlation and prediction of a large blood-brain distribution data set--an LFER study. European Journal of Medicinal Chemistry. 36: 719-30. PMID 11672881 DOI: 10.1016/S0223-5234(01)01269-7 |
0.419 |
|
2001 |
Zhao YH, Le J, Abraham MH, Hersey A, Eddershaw PJ, Luscombe CN, Butina D, Beck G, Sherborne B, Cooper I, Platts JA, Boutina D. Evaluation of human intestinal absorption data and subsequent derivation of a quantitative structure-activity relationship (QSAR) with the Abraham descriptors. Journal of Pharmaceutical Sciences. 90: 749-84. PMID 11357178 DOI: 10.1002/Jps.1031 |
0.31 |
|
2001 |
Abraham MH, Platts JA. Hydrogen bond structural group constants. The Journal of Organic Chemistry. 66: 3484-91. PMID 11348133 DOI: 10.1021/Jo001765S |
0.409 |
|
2000 |
Abraham MH, Du CM, Platts JA. Lipophilicity of the nitrophenols The Journal of Organic Chemistry. 65: 7114-8. PMID 11031037 DOI: 10.1021/Jo000840W |
0.408 |
|
2000 |
Platts JA, Abraham MH, Hersey A, Butina D. Estimation of molecular linear free energy relationship descriptors. 4. Correlation and prediction of cell permeation. Pharmaceutical Research. 17: 1013-8. PMID 11028950 DOI: 10.1023/A:1007543708522 |
0.426 |
|
2000 |
Platts JA, Abraham MH, Butina D, Hersey A. Estimation of molecular linear free energy relationship descriptors by a group contribution approach. 2. Prediction of partition coefficients Journal of Chemical Information and Computer Sciences. 40: 71-80. PMID 10661552 DOI: 10.1021/Ci990427T |
0.383 |
|
2000 |
Platts JA, Abraham MH. Partition of Volatile Organic Compounds from Air and from Water into Plant Cuticular Matrix: An LFER Analysis Environmental Science & Technology. 34: 318-323. DOI: 10.1021/Es9906195 |
0.357 |
|
1999 |
Abraham MH, Platts JA, Hersey A, Leo AJ, Taft RW. Correlation and estimation of gas-chloroform and water-chloroform partition coefficients by a linear free energy relationship method. Journal of Pharmaceutical Sciences. 88: 670-9. PMID 10393564 DOI: 10.1021/Js990008A |
0.385 |
|
1999 |
Platts JA, Butina D, Abraham MH, Hersey A. Estimation of Molecular Linear Free Energy Relation Descriptors Using a Group Contribution Approach Journal of Chemical Information and Computer Sciences. 39: 835-845. DOI: 10.1021/Ci980339T |
0.408 |
|
1998 |
Howard ST, Platts JA. Ab Initio Studies of Proton Sponges. 4. Calculating the Strain Energy The Journal of Organic Chemistry. 63: 3568-3571. DOI: 10.1021/jo972188j |
0.536 |
|
1996 |
Platts JA, Howard ST. Ab Initio Studies of Proton Sponges. 3. 4,5-Bis(dimethylamino)fluorene and 4,5-Bis(dimethylamino)phenanthrene. The Journal of Organic Chemistry. 61: 4480-4482. PMID 11667359 |
0.554 |
|
1996 |
Platts JA, Howard ST. Periodic Hartree–Fock calculations on crystalline HCN The Journal of Chemical Physics. 105: 4668-4674. DOI: 10.1063/1.472332 |
0.516 |
|
1996 |
Platts JA, Howard ST, Bracke BRF. Directionality of hydrogen bonds to sulfur and oxygen Journal of the American Chemical Society. 118: 2726-2733. DOI: 10.1021/ja952871s |
0.517 |
|
1995 |
Howard ST, Platts JA. Relationship between Phosphine Proton Affinities and Lone Pair Density Properties The Journal of Physical Chemistry. 99: 9027-9033. DOI: 10.1021/j100022a013 |
0.533 |
|
1995 |
Howard ST, Platts JA, Wo?niak K. On the barrier to molecular axial rotation in crystalline benzene Chemical Physics Letters. 239: 267-272. DOI: 10.1016/0009-2614(95)00487-O |
0.476 |
|
1995 |
Platts JA, Howard ST, Wo?niak K. Weak intermolecular interactions between nitrogen and oxygen atoms Chemical Physics Letters. 232: 479-485. DOI: 10.1016/0009-2614(94)01397-E |
0.49 |
|
1994 |
Platts JA, Howard ST, Wozniak K. Ab Initio Studies of Proton Sponges: 1,8-Bis(dimethylamino)naphthalene The Journal of Organic Chemistry. 59: 4647-4651. DOI: 10.1021/jo00095a046 |
0.56 |
|
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