Richard J. Hall

发表

Research data supporting "Observation of geometry dependence of conductivity in two-dimensional electron 2 systems"

Michael Pepper, Harvey E. Beere, David Ritchie, 2015 .

The Evolution of Color Vision without Colors

Richard J. Hall, R. Hall, 1996, Philosophy of Science.

Fourth Amendment--Eliminating the Inadvertent Discovery Requirement for Seizures Under the Plain View Doctrine

Richard J. Hall, 1991 .

Aspects of hybrid QM/MM calculations: The treatment of the QM/MM interface region and geometry optimization with an application to chorismate mutase

Richard J. Hall, Sally A. Hindle, N. Burton, 2000, J. Comput. Chem..

Aspects of hybrid QM/MM calculations: The treatment of the QM/MM interface region and geometry optimization with an application to chorismate mutase

Richard J. Hall, Sally A. Hindle, N. Burton, 2000 .

Efficient exploration of chemical space by fragment-based screening.

Christopher W Murray, Richard J. Hall, Paul N. Mortenson, 2014, Progress in biophysics and molecular biology.

Predicting "Hot" and "Warm" Spots for Fragment Binding.

Christopher W Murray, Richard J. Hall, Marcel L Verdonk, 2017, Journal of medicinal chemistry.

Modelling the reaction OH- + CO2 → HCO- 3 in the gas phase and in aqueous solution: a combined density functional continuum approach

Richard J. Hall, N. Burton, I. H. Hillier, 1994 .

Protein-Ligand Docking against Non-Native Protein Conformers

Marcel L. Verdonk, Michael J. Hartshorn, Richard J. Hall, 2008, J. Chem. Inf. Model..

Combined Density Functional, Self-Consistent Reaction Field Model of Solvation

Richard J. Hall, N. Burton, I. H. Hillier, 1995 .

Docking performance of fragments and druglike compounds.

Richard J. Hall, Paul N. Mortenson, C. Murray, 2011, Journal of medicinal chemistry.

Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design.

Richard J. Hall, C. Murray, H. Jhoti, 2019, Drug discovery today.

Crystallographic screening using ultra-low-molecular-weight ligands to guide drug design.

Richard J. Hall, C. Murray, H. Jhoti, 2019 .

Tautomerism in uracil, cytosine and guanine: a comparison of electron correlation predicted by ab initio and density functional theory methods

Richard J. Hall, I. Gould, N. Burton, 1995 .

Combined Hartree-Fock and density functional theory: a distributed memory parallel implementation

Richard J. Hall, N. Burton, I. H. Hillier, 1994 .

Fragment-based drug discovery: opportunities for organic synthesis

Richard J. Hall, C. Murray, T. Heightman, 2020, RSC medicinal chemistry.

Which density functional should be used to model hydration

Richard J. Hall, M. Vincent, I. H. Hillier, 2000 .

Aspects of hybrid QM/MM calculations: The treatment of the QM/MM interface region and geometry optimization with an application to chorismate mutase

Richard J. Hall, Sally A. Hindle, N. Burton, 2000, J. Comput. Chem..

Stereospecificity in Reactions of Allylstannanes with Aldehydes Explored by Electronic Structure Calculations.

Richard J. Hall, E. J. Thomas, M. Vincent, 1999, The Journal of organic chemistry.

Effect of Solvent on the Claisen Rearrangement of Allyl Vinyl Ether Using ab initio Continuum Methods

Richard J. Hall, N. Burton, I. H. Hillier, 1994 .

Adsorption energies of NH3 and NH4+ in zeolites. An embedded cluster model including electron correlation

Richard J. Hall, I. Gould, P. Sherwood, 1995 .

Potential and Limitations of Ensemble Docking

Oliver Korb, Jason C. Cole, Tjelvar S. G. Olsson, 2012, J. Chem. Inf. Model..

The Fragment Network: A Chemistry Recommendation Engine Built Using a Graph Database.

Christopher W Murray, Richard J. Hall, Marcel L Verdonk, 2017, Journal of medicinal chemistry.

Meaningful machine learning models and machine-learned pharmacophores from fragment screening campaigns

Lucy J. Colwell, Richard J. Hall, C. Murray, 2022, ArXiv.

Tautomeric equilibria in 2-hydroxypyridine and in cytosine. An assessment of density functional methods, including gradient corrections

Richard J. Hall, N. Burton, I. H. Hillier, 1994 .

Structure and stability of galena (PbS) at the interface with aqueous solution: a combined embedded cluster/reaction field study

Richard J. Hall, M. Vincent, I. H. Hillier, 2000 .