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51

Friedel–Crafts alkylation of benzene with 1,1- d 2 -1-chloropropane

Lee, C. C., Woodcock, D. J.

Journal:

Canadian Journal of Chemistry

Year:

1970

Language:

english

File:

PDF, 272 KB

english, 1970

52

Some observations on isotopic scramblings accompanying acetolysis in the 2-norbornyl system

Lee, C. C., Hahn, Bo-Sup, Lam, L. K. M., Woodcock, D. J.

Journal:

Canadian Journal of Chemistry

Year:

1970

Language:

english

File:

PDF, 480 KB

english, 1970

53

Does a complex intervention by primary care nurses increase walking in older people? Outcomes at 3 and 12 months in the PACE-Lift (Pedometer Accelerometer Consultation Evaluation-Lift) cluster-randomised controlled trial

Harris, Tess, Kerry, Sally M, Victor, Christina R, Ekelund, Ulf, Woodcock, Alison, Iliffe, Steve, Whincup, Peter H, Beighton, Carole, Ussher, Michael, Limb, Elizabeth, David, Lee, Brewin, Debbie, Adam

Journal:

Year:

2014

Language:

english

File:

PDF, 57 KB

english, 2014

54

Efficiently computing pathway free energies: New approaches based on chain-of-replica and Non-Boltzmann Bennett reweighting schemes

Hudson, Phillip S., White, Justin K., Kearns, Fiona L., Hodoscek, Milan, Boresch, Stefan, Lee Woodcock, H.

Journal:

Biochimica et Biophysica Acta (BBA) - General Subjects

Year:

2015

Language:

english

File:

PDF, 1.28 MB

english, 2015

55

Development and implementation of (Q)SAR modeling within the CHARMMing web-user interface

Weidlich, Iwona E., Pevzner, Yuri, Miller, Benjamin T., Filippov, Igor V., Woodcock, H. Lee, Brooks, Bernard R.

Journal:

Journal of Computational Chemistry

Year:

2015

Language:

english

File:

PDF, 275 KB

english, 2015

56

Sumoylated Human Histone H4 Prevents Chromatin Compaction by Inhibiting Long-range Internucleosomal Interactions

Dhall, Abhinav, Wei, Sijie, Fierz, Beat, Woodcock, Christopher L., Lee, Tae-Hee, Chatterjee, Champak

Journal:

Journal of Biological Chemistry

Year:

2014

Language:

english

File:

PDF, 2.34 MB

english, 2014

57

Molecular Cloning and Characterization of CFT1, a Developmentally Regulated Avian (1,3)-Fucosyltransferase Gene

Lee, K. P., Carlson, L. M., Woodcock, J. B., Ramachandra, N., Schultz, T. L., Davis, T. A., Lowe, J. B., Thompson, C. B., Larsen, R. D.

Journal:

Journal of Biological Chemistry

Year:

1996

Language:

english

File:

PDF, 914 KB

english, 1996

58

Ligand-Induced Proton Transfer and Low-Barrier Hydrogen Bond Revealed by X-ray Crystallography

Nichols, Derek A., Hargis, Jacqueline C., Sanishvili, Ruslan, Jaishankar, Priyadarshini, Defrees, Kyle, Smith, Emmanuel W., Wang, Kenneth K., Prati, Fabio, Renslo, Adam R., Woodcock, H. Lee, Chen, Yu

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 2.74 MB

english, 2015

59

Distribution and Functional Role of Inositol 1,4,5-trisphosphate Receptors in Mouse Sinoatrial Node

Ju, Y.-K., Liu, J., Lee, B. H., Lai, D., Woodcock, E. A., Lei, M., Cannell, M. B., Allen, D. G.

Journal:

Circulation Research

Year:

2011

Language:

english

File:

PDF, 5.63 MB

english, 2011

60

A Primary Care Nurse-Delivered Walking Intervention in Older Adults: PACE (Pedometer Accelerometer Consultation Evaluation)-Lift Cluster Randomised Controlled Trial

Harris, Tess, Kerry, Sally M., Victor, Christina R., Ekelund, Ulf, Woodcock, Alison, Iliffe, Steve, Whincup, Peter H., Beighton, Carole, Ussher, Michael, Limb, Elizabeth S., David, Lee, Brewin, Debbie

Journal:

Year:

2015

Language:

english

File:

PDF, 564 KB

english, 2015

61

Web-Based Computational Chemistry Education with CHARMMing III: Reduction Potentials of Electron Transfer Proteins

Perrin, B. Scott, Miller, Benjamin T., Schalk, Vinushka, Woodcock, H. Lee, Brooks, Bernard R., Ichiye, Toshiko, Cui, Qiang

Journal:

PLoS Computational Biology

Year:

2014

Language:

english

File:

PDF, 840 KB

english, 2014

62

Web-Based Computational Chemistry Education with CHARMMing II: Coarse-Grained Protein Folding

Pickard, Frank C., Miller, Benjamin T., Schalk, Vinushka, Lerner, Michael G., Woodcock, H. Lee, Brooks, Bernard R., Cui, Qiang

Journal:

PLoS Computational Biology

Year:

2014

Language:

english

File:

PDF, 581 KB

english, 2014

63

Web-Based Computational Chemistry Education with CHARMMing I: Lessons and Tutorial

Miller, Benjamin T., Singh, Rishi P., Schalk, Vinushka, Pevzner, Yuri, Sun, Jingjun, Miller, Carrie S., Boresch, Stefan, Ichiye, Toshiko, Brooks, Bernard R., Woodcock, H. Lee, Cui, Qiang

Journal:

PLoS Computational Biology

Year:

2014

Language:

english

File:

PDF, 1.43 MB

english, 2014

64

Pathological hypertrophy reverses 2-adrenergic receptor-induced angiogenesis in mouse heart

Xu, Q., Jennings, N. L., Sim, K., Chang, L., Gao, X.-M., Kiriazis, H., Lee, Y. Y., Nguyen, M.-N., Woodcock, E. A., Zhang, Y.-Y., El-Osta, A., Dart, A. M., Du, X.-J.

Journal:

Physiological Reports

Year:

2015

Language:

english

File:

PDF, 3.14 MB

english, 2015

65

Photoacoustic calorimetry study of ligand photorelease from the Ru(II)bis(2,2′-bipyridine)(6,6′-dimethyl-2,2′-bipyridine) complex in aqueous solution

Word, Tarah A., Whittington, Christi L., Karolak, Aleksandra, Kemp, M. Trent, Woodcock, H. Lee, van der Vaart, Arjan, Larsen, Randy W.

Journal:

Chemical Physics Letters

Year:

2015

Language:

english

File:

PDF, 531 KB

english, 2015

66

Vibrational subsystem analysis: A method for probing free energies and correlations in the harmonic limit

Woodcock, H. Lee, Zheng, Wenjun, Ghysels, An, Shao, Yihan, Kong, Jing, Brooks, Bernard R.

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 633 KB

english, 2008

67

Use of Non-equilibrium Work Methods to Compute Free Energy Differences between MM and QM Representations of Molecular Systems

Hudson, Phillip S., Woodcock, H. Lee, Boresch, Stefan

Journal:

The Journal of Physical Chemistry Letters

Year:

2015

Language:

english

File:

PDF, 1.50 MB

english, 2015

68

Computation of Hydration Free Energies Using the Multiple Environment Single System Quantum Mechanical/Molecular Mechanical (MESS-QM/MM) Method

König, Gerhard, Mei, Ye, Pickard, Frank C, Simmonett, Andrew C, Miller, Benjamin T., Herbert, John M., Woodcock, H. Lee, Brooks, Bernard R., Shao, Yihan

Journal:

Journal of Chemical Theory and Computation

Year:

2015

Language:

english

File:

PDF, 431 KB

english, 2015

69

Sequential administration of varying doses of dacarbazine and fotemustine in advanced malignant melanoma

Lee, SM, Margison, GP, Woodcock, AA, Thatcher, N

Journal:

British Journal of Cancer

Year:

1993

Language:

english

File:

PDF, 1.09 MB

english, 1993

70

20 Transformation of EML4/ALK positive adenocarcinoma of the lung to small cell lung cancer following ALK targeted therapy

Lees, C.E., Woodcock, V., Nicholson, A., Talbot, D.

Journal:

Year:

2016

Language:

english

File:

PDF, 55 KB

english, 2016

71

The conserved active site histidine-glutamate pair of ferrochelatase coordinately catalyzes porphyrin metalation

Hunter, Gregory A., Vankayala, Sai Lakshmana, Gillam, Mallory E., Kearns, Fiona L., Woodcock, H. Lee, Ferreira, Gloria C.

Journal:

Journal of Porphyrins and Phthalocyanines

Year:

2016

Language:

english

File:

PDF, 3.24 MB

english, 2016

72

Ruthenium(II)Bis(2,2′-Bipyridine) Interactions with Nucleaobases- Models for DNA Binding

Larsen, Randy W., Whittington, Chrsiti L., Kemp, Michael T., Word, Tarah, Woodcock, H. Lee, Larsen, Randy W.

Journal:

Biophysical Journal

Year:

2015

Language:

english

File:

PDF, 56 KB

english, 2015

73

SOCRATES - Steroid or Cyclosporin Removal after Transplantation Using Everolimus: Histological Analysis

Chadban, S., Eris, J., Pilmore, H., Lee, P., Woodcock, C., Kurstjens, N., Russ, G.

Journal:

Transplantation Journal

Year:

2012

Language:

english

File:

PDF, 623 KB

english, 2012

74

Accelerated Access to Innovative Medicines for Patients in Need

Baird, L G, Banken, R, Eichler, H-G, Kristensen, F B, Lee, D K, Lim, J C W, Lim, R, Longson, C, Pezalla, E, Salmonson, T, Samaha, D, Tunis, S, Woodcock, J, Hirsch, G

Journal:

Clinical Pharmacology & Therapeutics

Year:

2014

Language:

english

File:

PDF, 331 KB

english, 2014

75

Thiamin Diphosphate Activation in 1-Deoxy-D-Xylulose 5-Phosphate Synthase: Insights into the Mechanism and Underlying Intermolecular Interactions

White, Justin K., Handa, Sumit, Vankayala, Sai Lakshmana, Merkler, David J., Woodcock, H. Lee

Journal:

Journal of Physical Chemistry B

Year:

2016

Language:

english

File:

PDF, 6.76 MB

english, 2016

76

Assessing Mental Skill and Technique Use in Applied Interventions: Recognizing and Minimizing Threats to the Psychometric Properties of the TOPS

Woodcock, Charlotte, Duda, Joan L., Cumming, Jennifer, Sharp, Lee-Ann, Holland, Mark J.G.

Journal:

The Sport Psychologist

Year:

2012

Language:

english

File:

PDF, 479 KB

english, 2012

77

Elucidating a chemical defense mechanism of Antarctic sponges: A computational study

Vankayala, Sai Lakshmana, Kearns, Fiona L., Baker, Bill J., Larkin, Joseph D., Woodcock, H. Lee

Journal:

Journal of Molecular Graphics and Modelling

Year:

2016

Language:

english

File:

PDF, 25.27 MB

english, 2016

78

Disaggregation is a Mechanism for Emission Turn-On of ortho -Aminomethylphenylboronic Acid-Based Saccharide Sensors

Chapin, Brette M., Metola, Pedro, Vankayala, Sai Lakshmana, Woodcock, H. Lee, Mooibroek, Tiddo J., Lynch, Vincent M., Larkin, Joseph D., Anslyn, Eric V.

Journal:

Journal of the American Chemical Society

Year:

2017

Language:

english

File:

PDF, 1.24 MB

english, 2017

79

Convergence of single-step free energy perturbation

Boresch, Stefan, Woodcock, H. Lee

Journal:

Molecular Physics

Year:

2016

Language:

english

File:

PDF, 940 KB

english, 2016

80

Genetic, Radiologic and Clinical Variability in Brown-Vialetto-Van Laere Syndrome

Woodcock, Ian R., Menezes, Manoj P., Coleman, Lee, Yaplito-Lee, Joy, Peters, Heidi, White, Susan M., Stapleton, Rachel, Phelan, Dean G., Chong, Belinda, Lunke, Sebastian, Stark, Zornitza, Pitt, James,

Journal:

Seminars in Pediatric Neurology

Year:

2017

Language:

english

File:

PDF, 1008 KB

english, 2017

81

Synthesis and β-sheet propensity of constrained N -amino peptides

Sarnowski, Matthew P., Pedretty, Kyle P., Giddings, Nicole, Woodcock, H. Lee, Del Valle, Juan R.

Journal:

Bioorganic & Medicinal Chemistry

Year:

2017

Language:

english

File:

PDF, 1.04 MB

english, 2017

82

How Mechanical Forces on the Ribosome Modulate the Speed of Protein Synthesis

Fritch, Benjamin, Leininger, Sarah, Hudson, Phillip, Woodcock, Lee, Deutsch, Carol, O'Brien, Edward P.

Journal:

Biophysical Journal

Year:

2018

Language:

english

File:

PDF, 44 KB

english, 2018

83

Origins of the mechanochemical coupling of peptide bond formation to protein synthesis

Fritch, Benjamin, Kosolapov, Andrey, Hudson, Phillip S., Nissley, Daniel A., Woodcock, H. Lee, Deutsch, Carol, O'Brien, Edward P.

Journal:

Journal of the American Chemical Society

Year:

2018

Language:

english

File:

PDF, 1.20 MB

english, 2018

84

The long non‐coding RNA Paupar promotes KAP1‐dependent chromatin changes and regulates olfactory bulb neurogenesis

Pavlaki, Ioanna, Alammari, Farah, Sun, Bin, Clark, Neil, Sirey, Tamara, Lee, Sheena, Woodcock, Dan J, Ponting, Chris P, Szele, Francis G, Vance, Keith W

Journal:

The EMBO Journal

Year:

2018

Language:

english

File:

PDF, 4.72 MB

english, 2018

85

ChemInform Abstract: FRIEDEL-CRAFTS-ALKYLIERUNG VON BENZOL MIT 1-CHLOR-(1,1-D2)PROPAN

LEE, C. C., WOODCOCK, D. J.

Journal:

Chemischer Informationsdienst. Organische Chemie

Year:

1970

File:

PDF, 114 KB

1970

86

Globalisation and health

Lee, K., Bradley, D., Ahern, M., McMichael, T., Butler, C., Legge, D., Rao, J. N, Feachem, R. G A, Woodcock, J., Porter, A., Saracci, R., Cuttini, M., Macq, J.

Journal:

Year:

2002

Language:

english

File:

PDF, 348 KB

english, 2002

87

ChemInform Abstract: BEOBACHTUNGEN DER ISOTOPENVERTEILUNG BEI DER ACETOLYSE DES NORBORNYL-(2)-SYST.

LEE, C. C., HAHN, BO-SUP, LAM, L. K. M., WOODCOCK, D. J.

Journal:

Chemischer Informationsdienst. Organische Chemie

Year:

1971

File:

PDF, 92 KB

1971

88

ChemInform Abstract: RK. VON CYCLOPROPAN MIT HCL UND VON BROMCYCLOPROPAN MIT BROMWASSERSTOFF

LEE, C. C., HAHN, B.-S., WAN, K.-M., WOODCOCK, D. J.

Journal:

Chemischer Informationsdienst. Organische Chemie

Year:

1970

File:

PDF, 100 KB

1970

89

Mechanistic Studies of 1-Deoxy-D-Xylulose-5-Phosphate Synthase from Deinococcus radiodurans

Handa, Sumit, Dempsey, Daniel R, Ramamoorthy, Divya, Cook, Nanci, Guida, Wayne C, Spradling, Tyler J, White, Justin K, Woodcock, H Lee, Merkler, David J

Journal:

Biochemistry & Molecular Biology Journal

Year:

2018

Language:

english

File:

PDF, 1.10 MB

english, 2018

90

Force matching as a stepping stone to QM/MM CB[8] host/guest binding free energies: a SAMPL6 cautionary tale

Hudson, Phillip S., Han, Kyungreem, Woodcock, H. Lee, Brooks, Bernard R.

Journal:

Journal of Computer-Aided Molecular Design

Year:

2018

Language:

english

File:

PDF, 2.22 MB

english, 2018

91

Accelerating QM/MM Free Energy Computations via Intramolecular Force Matching

Hudson, Phillip S., Boresch, Stefan, Rogers, David M., Woodcock, H. Lee

Journal:

Journal of Chemical Theory and Computation

Year:

2018

Language:

english

File:

PDF, 2.80 MB

english, 2018

92

Modeling Boronic Acid Based Flourescent Saccharide Sensors: Computational Investigation of d-Fructose Binding to Dimethylaminomethylphenylboronic Acid (DMPBA)

Kearns, Fiona, Robart, Carrie, Kemp, Michael T, Vankayala, Sai Lakshmana, Chapin, Brette M, Anslyn, Eric Van, Woodcock, H. Lee, Larkin, Joseph D.

Journal:

Journal of Chemical Information and Modeling

Year:

2019

File:

PDF, 6.53 MB

2019

93

On the use of interaction energies in QM/MM free energy simulations

Hudson, Phillip S., Woodcock, H. Lee, Boresch, Stefan

Journal:

Journal of Chemical Theory and Computation

Year:

2019

Language:

english

File:

PDF, 1.00 MB

english, 2019

94

A multidisciplinary consensus on dehydration: definitions, diagnostic methods and clinical implications

Lacey, Jonathan, Corbett, Jo, Forni, Lui, Hooper, Lee, Hughes, Fintan, Minto, Gary, Moss, Charlotte, Price, Susanna, Whyte, Greg, Woodcock, Tom, Mythen, Michael, Montgomery, Hugh

Journal:

Annals of Medicine

Year:

2019

Language:

english

File:

PDF, 1.92 MB

english, 2019

95

ChemInform Abstract: PROTONIERTE CYCLOPROPANE 5. MITT. BEHANDLUNG VON 1-CHLOR-(1-(14)C)-PROPAN MIT ALUMINIUMCHLORID

LEE, C. C., WOODCOCK, D. J.

Journal:

Chemischer Informationsdienst. Organische Chemie

Year:

1970

File:

PDF, 205 KB

1970

96

Î´-Azaproline and its oxidized variants

Elbatrawi, Yassin M, Pedretty, Kyle P, Giddings, Nicole, Woodcock, H. Lee, Del Valle, Juan R

Journal:

Journal of Organic Chemistry

Year:

2020

Language:

english

File:

PDF, 3.49 MB

english, 2020

97

Mechanism of proton transfer in class A Î²-lactamase catalysis and inhibition by avibactam

Pemberton, Orville A., Noor, Radwan E., Kumar M. V., Vasantha, Sanishvili, Ruslan, Kemp, M. Trent, Kearns, Fiona L., Woodcock, H. Lee, Gelis, Ioannis, Chen, Yu

Journal:

Proceedings of the National Academy of Sciences

Year:

2020

Language:

english

File:

PDF, 1.24 MB

english, 2020

98

Long Range Endocrine Delivery of Circulating miR-210 to Endothelium Promotes Pulmonary Hypertension

Zhao, Jingsi, Florentin, Jonathan, Tai, Yi Yin, Torrino, StÃ©phanie, Ohayon, Lee, Brzoska, Tomasz, Tang, Ying, Yang, Jimin, Negi, Vinny, Woodcock, Chen-Shan Chen, Risbano, Michael George, Nouraie, Meh

Journal:

Circulation Research

Year:

2020

File:

PDF, 1.92 MB

2020

99

Hierarchical Markov State Model Building to Describe Molecular Processes

Wolfe, David K., Persichetti, Joseph R., Sharma, Ajeet K., Hudson, Phillip S., Woodcock, H. Lee, OâBrien, Edward P.

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 1.94 MB

2020

100

Enantiomerization of Axially Chiral Biphenyls: Polarizable MD Simulations in Water and Butylmethylether

Zeindlhofer, Veronika, Hudson, Phillip, PÃ¡lvÃ¶lgyi, ÃdÃ¡m MÃ¡rk, Welsch, Matthias, Almarashi, Mazin, Woodcock, H. Lee, Brooks, Bernard, Bica-SchrÃ¶der, Katharina, SchrÃ¶der, Christian

Journal:

International Journal of Molecular Sciences

Year:

2020

File:

PDF, 4.97 MB

2020