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Computational studies of HCCCCS isomers

Molecular physics, 2024-04, Vol.122 (7-8)

2024

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Accurate prediction of the properties of materials using the CAM‐B3LYP density functional

Journal of computational chemistry, 2021-08, Vol.42 (21), p.1486-1497

2021

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Feature Engineering for Materials ChemistryDoes Size Matter?

Journal of chemical information and modeling, 2019-05, Vol.59 (5), p.1873-1881

2019

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Density Functional Theory for Charge Transfer: The Nature of the N-Bands of Porphyrins and Chlorophylls Revealed through CAM-B3LYP, CASPT2, and SAC-CI Calculations

The journal of physical chemistry. B, 2006-08, Vol.110 (31), p.15624-15632

2006

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Bone marrow necrosis and fat embolism syndrome in sickle cell disease: Increased susceptibility of patients with non-SS genotypes and a possible association with human parvovirus B19 infection

Blood reviews, 2014, Vol.28 (1), p.23-30

2014

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Density functionals with asymptotic-potential corrections are required for the simulation of spectroscopic properties of materials

Chemical science (Cambridge), 2022-02, Vol.13 (5), p.1492-153

2022

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Application of the Systematic Molecular Fragmentation by Annihilation Method to ab Initio NMR Chemical Shift Calculations

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2018-11, Vol.122 (46), p.9135-9141

2018

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Evaluation of Machine Learning Interatomic Potentials for Gold Nanoparticles-Transferability towards Bulk

Nanomaterials (Basel, Switzerland), 2023-06, Vol.13 (12), p.1832

2023

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Regular automated red cell exchange transfusion in the management of stuttering priapism complicating sickle cell disease

British journal of haematology, 2018-02, Vol.180 (4), p.585-588

2018

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Revisiting fat embolism in sickle syndromes: diagnostic and emergency therapeutic measures

British journal of haematology, 2019-08, Vol.186 (4), p.e112-e115

2019

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Studies of the Ground and Excited-State Surfaces of the Retinal Chromophore using CAM-B3LYP

The journal of physical chemistry. B, 2010-04, Vol.114 (16), p.5547-5555

2010

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Microsolvation within the Systematic Molecular Fragmentation by Annihilation Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2017-01, Vol.121 (1), p.334-341

2017

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The application of CAM-B3LYP to the charge-transfer band problem of the zincbacteriochlorin–bacteriochlorin complex

Chemical physics letters, 2006-03, Vol.420 (1), p.106-109

2006

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Clinical outcomes in children with sickle cell disease living in England: a neonatal cohort in East London

Haematologica (Roma), 2007-07, Vol.92 (7), p.905-912

2007

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Evaluation of Machine Learning Interatomic Potentials for the Properties of Gold Nanoparticles

Nanomaterials (Basel, Switzerland), 2022-11, Vol.12 (21), p.3891

2022

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Ab initio investigation of the structures and energies of spiropyran and merocyanine isomers

Molecular physics, 2015-07, Vol.113 (13-14), p.1674-1681

2015

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Regular automated red cell exchange transfusion in the management of pulmonary hypertension in sickle cell disease

British journal of haematology, 2014-12, Vol.167 (5), p.707-710

2014

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Theoretical investigation of the isomerisation of merocyanine

Molecular physics, 2013-07, Vol.111 (9-11), p.1574-1579

2013

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Distinct patterns of response to transfusion therapy for different chronic complications of sickle cell disease: A useful insight

Transfusion and apheresis science, 2017-10, Vol.56 (5), p.713-716

2017

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Automated Red Cell Exchange in the Management of Sickle Cell Disease

Journal of clinical medicine, 2021-02, Vol.10 (4), p.767

2021

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Safety, tolerability, and outcomes of regular automated red cell exchange transfusion in the management of sickle cell disease

Journal of clinical apheresis, 2016-12, Vol.31 (6), p.545-550

2016

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A 5-year cost analysis of automated red cell exchange transfusion for the management of recurrent painful crises in adult patients with sickle cell disease

Transfusion and apheresis science, 2017-06, Vol.56 (3), p.466-469

2017

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Comparing long-range corrected functionals in the cis-trans isomerisation of the retinal chromophore

Molecular physics, 2012-10, Vol.110 (19-20), p.2329-2336

2012

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The SMFA program for quantum chemistry calculations on large molecules

Wiley interdisciplinary reviews. Computational molecular science, 2019-09, Vol.9 (5), p.e1413-n/a

2019

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Comparison of serial serum ferritin measurements and liver iron concentration assessed by MRI in adult transfused patients with sickle cell disease

European journal of haematology, 2014-02, Vol.92 (2), p.164-167

2014

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Computational studies of HCCCCS isomers

Accurate prediction of the properties of materials using the CAM‐B3LYP density functional

Feature Engineering for Materials ChemistryDoes Size Matter?

Density Functional Theory for Charge Transfer: The Nature of the N-Bands of Porphyrins and Chlorophylls Revealed through CAM-B3LYP, CASPT2, and SAC-CI Calculations

Bone marrow necrosis and fat embolism syndrome in sickle cell disease: Increased susceptibility of patients with non-SS genotypes and a possible association with human parvovirus B19 infection

Density functionals with asymptotic-potential corrections are required for the simulation of spectroscopic properties of materials

Application of the Systematic Molecular Fragmentation by Annihilation Method to ab Initio NMR Chemical Shift Calculations

Evaluation of Machine Learning Interatomic Potentials for Gold Nanoparticles-Transferability towards Bulk

Regular automated red cell exchange transfusion in the management of stuttering priapism complicating sickle cell disease

Revisiting fat embolism in sickle syndromes: diagnostic and emergency therapeutic measures

Studies of the Ground and Excited-State Surfaces of the Retinal Chromophore using CAM-B3LYP

Microsolvation within the Systematic Molecular Fragmentation by Annihilation Approach

The application of CAM-B3LYP to the charge-transfer band problem of the zincbacteriochlorin–bacteriochlorin complex

Clinical outcomes in children with sickle cell disease living in England: a neonatal cohort in East London

Evaluation of Machine Learning Interatomic Potentials for the Properties of Gold Nanoparticles

Ab initio investigation of the structures and energies of spiropyran and merocyanine isomers

Regular automated red cell exchange transfusion in the management of pulmonary hypertension in sickle cell disease

Theoretical investigation of the isomerisation of merocyanine

Distinct patterns of response to transfusion therapy for different chronic complications of sickle cell disease: A useful insight

Automated Red Cell Exchange in the Management of Sickle Cell Disease

Safety, tolerability, and outcomes of regular automated red cell exchange transfusion in the management of sickle cell disease

A 5-year cost analysis of automated red cell exchange transfusion for the management of recurrent painful crises in adult patients with sickle cell disease

Comparing long-range corrected functionals in the cis-trans isomerisation of the retinal chromophore

The SMFA program for quantum chemistry calculations on large molecules

Comparison of serial serum ferritin measurements and liver iron concentration assessed by MRI in adult transfused patients with sickle cell disease

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