Chemistry

Oct

26

Improved Synthesis of Two-Dimensional Covalent...

12:00pm

Will Dichtel

CP-114

2

Mapping Allosteric Communication Pathways in...

12:00pm

Donald Hamelberg

CP-114

9

Departmental Seminar

12:00pm

Michael Feig

CP-114

Thursday

22

Thanksgiving Break - Offices Closed

(All day)

30

Departmental Seminar

12:00pm

Maureen Tang, Drexel University

CP-114

Dec

7

Departmental Seminar

12:00pm

Carsten Milsmann

CP-114

Apr

5

45th Annual Naff Symposium

8:00am

WT Young Library / JSB

More Events

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Videos
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22nd Annual Lyle Ramsay Dawson Lecture

Chemistry Faculty Poster Session

A&S K-Week Introduction

2018 STEMCats Teaching Workshop

2018 Regional Undergraduate Poster Competition

2018 Chemistry Graduation and Student Awards Ceremony

2018 Naff Symposium

Dawson Lecture 2017

Chemistry Faculty Poster Session

2017 Regional Undergraduate Poster Competition

2017 Chemistry Graduation and Student Awards Ceremony

Expanding Your Horizons Conference

Faculty Awards and Recognition Ceremony 2017

Naff Symposium 2017

STEM Night at Veterans Park Elementary

2016 Dawson Lecture and Chemistry Reunion

Major in Chemistry - Niranjana

Inside the Classroom: Upper Division Organic Chemistry Lab

Major in Chemistry Series

Investigating Nanostructure Synthesis Using In Situ TEM

Where do the Proton Mass and Spin Come From?

Organic Compounds for Advanced Batteries

About the UK Neuroscience Program

Topping Off the Academic Science Building

Biology and Chemistry Chairs Onsite at the Academic Science Building

Dean Kornbluh Onsite at the Academic Science Building

Jeff Babbitt, Scientific Glassblower

Arts & Sciences Hall of Fame 2014

A&S Hall of Fame 2014 - Dr. George H. Scherr

Naff Symposium 2014: Todd Yeates, "Giant Protein Cages and...

Naff Symposium 2014: Donald E. Ingber, "From Cellular...

Naff Symposium 2014: Hao Yan, "Designer Architectures for...

Organic Chemistry and Student Success with Susan Odom

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The Right Vintage: Sitting Down with A&S Alum Robert Young

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STEMCats: Assisting with Science

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New Faculty 2014: Meet Chad Risko

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New Faculty 2014: Meet Peter Kekenes-Huskey

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New Faculty 2014: Meet Kenneth Graham

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Learning a Hard Science: The Chemistry Learning Center with Lisa Blue

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Spirit Chemistry: Dispelling Distillation Deceptions with Bert Lynn

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Bonding with the Digital Commons: An Interview with Kim Woodrum

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Research Rewarded: Marcelo Guzman

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Following the Campaign Trail: Currents Fall 2012

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DNA Criminology and Chemistry: John Brown

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New Faculty 2012: Meet Chris Richards

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Fabulous Catalysts and the NMR Lab: Anne-Frances Miller

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Improving General Chemistry with Stephen Testa

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Fighting Alzheimer's with Antioxidants: Allan Butterfield

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Recent Chemistry Publications

Stewart, BD ; Scott, CE ; McCoy, TP ; Yin, G ; Despa, F ; Despa, S ; Kekenes-Huskey, PM "Computational modeling of amylin-induced calcium dysregulation in rat ventricular cardiomyocytes." Cell calcium 2018, 71, 65-74.

Sun, B ; Cook, EC ; Creamer, TP ; Kekenes-Huskey, PM "Electrostatic control of calcineurin's intrinsically-disordered regulatory domain binding to calmodulin." Biochimica et biophysica acta. General subjects 2018, 1862, 12 2651-2659.

Shariaty, D.A. ; Cheng, Y.T. ; Odom, S.A. "Application of Cross-Linked Polyborosiloxanes and Organically Modified Boron Silicate Binders in Silicon-Containing Anodes for Lithium-ion Batteries" Journal of the Electrochemical Society 2018, 165, A731-A735.

Uddin, Md Aslam; Calabro, Rosemary L.; Kim, Doo-Young ; Graham, Kenneth R. "Halide exchange and surface modification of metal halide perovskite nanocrystals with alkyltrichlorosilanes" Nanoscale 2018,

Scott, CE ; Kekenes-Huskey, PM "Molecular Basis of S100A1 Activation at Saturating and Subsaturating Calcium Concentrations." Biophysical journal 2016, 110, 5 1052-63.

Scott, CE ; Kekenes-Huskey, PM "Molecular Basis of S100A1 Activation at Saturating and Subsaturating Calcium Concentrations." Biophysical journal 2016, 110, 8 1907.

Kucharski, AN ; Scott, CE ; Davis, JP ; Kekenes-Huskey, PM "Understanding Ion Binding Affinity and Selectivity in β-Parvalbumin Using Molecular Dynamics and Mean Spherical Approximation Theory." The journal of physical chemistry. B 2016, 120, 33 8617-30.

Kekenes-Huskey, PM ; Scott, CE ; Atalay, S "Quantifying the Influence of the Crowded Cytoplasm on Small Molecule Diffusion." The journal of physical chemistry. B 2016, 120, 33 8696-706.

Lindert, S ; Cheng, Y.; Kekenes-Huskey, P ; Regnier, M ; McCammon, JA "Effects of HCM cTnI mutation R145G on troponin structure and modulation by PKA phosphorylation elucidated by molecular dynamics simulations." Biophysical journal 2015, 108, 2 395-407.

Kekenes-Huskey, PM ; Gillette, AK ; McCammon, JA "Erratum: "Predicting the influence of long-range molecular interactions on macroscopic-scale diffusion by homogenization of the Smoluchowski equation" J. Chem. Phys. 140, 174106 (2014) ." The Journal of chemical physics 2015, 142, 10 109902.

Kekenes-Huskey, PM ; Eun, C ; McCammon, JA "Enzyme localization, crowding, and buffers collectively modulate diffusion-influenced signal transduction: Insights from continuum diffusion modeling." The Journal of chemical physics 2015, 143, 9 094103.

Hake, J ; Kekenes-Huskey, PM ; McCulloch, AD "Computational modeling of subcellular transport and signaling." Current opinion in structural biology 2014, 25, 92-7.

Eun, C ; Kekenes-Huskey, PM ; Metzger, VT ; McCammon, JA "A model study of sequential enzyme reactions and electrostatic channeling." The Journal of chemical physics 2014, 140, 10 105101.

Kekenes-Huskey, PM ; Gillette, AK ; McCammon, JA "Predicting the influence of long-range molecular interactions on macroscopic-scale diffusion by homogenization of the Smoluchowski equation." The Journal of chemical physics 2014, 140, 17 174106.

Cheng, Y.; Lindert, S ; Kekenes-Huskey, P ; Rao, VS ; Solaro, RJ ; Rosevear, PR ; Amaro, R ; McCulloch, AD ; McCammon, JA ; Regnier, M "Computational studies of the effect of the S23D/S24D troponin I mutation on cardiac troponin structural dynamics." Biophysical journal 2014, 107, 7 1675-85.

Metzger, VT ; Eun, C ; Kekenes-Huskey, PM ; Huber, G ; McCammon, JA "Electrostatic channeling in P. falciparum DHFR-TS: Brownian dynamics and Smoluchowski modeling." Biophysical journal 2014, 107, 10 2394-402.

Wang, N ; Zhou, S ; Kekenes-Huskey, PM ; Li, B.; McCammon, JA "Poisson-Boltzmann versus Size-Modified Poisson-Boltzmann Electrostatics Applied to Lipid Bilayers." The journal of physical chemistry. B 2014, 118, 51 14827-32.

Eun, C ; Kekenes-Huskey, PM ; McCammon, JA "Influence of neighboring reactive particles on diffusion-limited reactions." The Journal of chemical physics 2013, 139, 4 044117.

Kekenes-Huskey, PM ; Liao, T ; Gillette, AK ; Hake, JE ; Zhang, Y.; Michailova, AP ; McCulloch, AD ; McCammon, JA "Molecular and subcellular-scale modeling of nucleotide diffusion in the cardiac myofilament lattice." Biophysical journal 2013, 105, 9 2130-40.

Liao, T ; Zhang, Y.; Kekenes-Huskey, PM ; Cheng, Y.; Michailova, A ; McCulloch, AD ; Holst, M ; McCammon, JA "Multi-core CPU or GPU-accelerated Multiscale Modeling for Biomolecular Complexes." Molecular Based Mathematical Biology (Online) 2013, 1,

Lindert, S ; Kekenes-Huskey, PM ; Huber, G ; Pierce, L ; McCammon, JA "Dynamics and calcium association to the N-terminal regulatory domain of human cardiac troponin C: a multiscale computational study." The journal of physical chemistry. B 2012, 116, 29 8449-59.

Hake, J ; Edwards, AG ; Yu, Z.; Kekenes-Huskey, PM ; Michailova, AP ; McCammon, JA ; Holst, MJ ; Hoshijima, M ; McCulloch, AD "Modelling cardiac calcium sparks in a three-dimensional reconstruction of a calcium release unit." The Journal of physiology 2012, 590, 18 4403-22.

Kekenes-Huskey, PM ; Metzger, VT ; Grant, BJ ; McCammon, Andrew "Calcium binding and allosteric signaling mechanisms for the sarcoplasmic reticulum Ca²+ ATPase." Protein science : a publication of the Protein Society 2012, 21, 10 1429-43.

Lindert, S ; Kekenes-Huskey, PM ; McCammon, JA "Long-timescale molecular dynamics simulations elucidate the dynamics and kinetics of exposure of the hydrophobic patch in troponin C." Biophysical journal 2012, 103, 8 1784-9.

Kekenes-Huskey, PM ; Gillette, A ; Hake, J ; McCammon, JA "Finite Element Estimation of Protein-Ligand Association Rates with Post-Encounter Effects: Applications to Calcium binding in Troponin C and SERCA." Computational science & discovery 2012, 5,

Cheng, Y.; Kekenes-Huskey, P ; Hake, J ; Holst, M ; McCammon, J ; Michailova, A "Multi-Scale Continuum Modeling of Biological Processes: From Molecular Electro-Diffusion to Sub-Cellular Signaling Transduction." Computational science & discovery 2012, 5, 1

Barone, E.; Cenini, G.; Di Domenico, F.; Martin, S.; Sultana, R.; Mancuso, C.; Murphy, MP ; Head, E.; Butterfield, DA "Long-term high-dose atorvastatin decreases brain oxidative and nitrosative stress in a preclinical model of Alzheimer disease: a novel mechanism of action." Pharmacological research : the official journal of the Italian Pharmacological Society 2011, 63, 3 172-80.

Butterfield, DA ; Owen, JB "Lectin-affinity chromatography brain glycoproteomics and Alzheimer disease: insights into protein alterations consistent with the pathology and progression of this dementing disorder." Proteomics. Clinical applications 2011, 5, 1-2 50-6.

Butterfield, DA ; Barone, E.; Mancuso, C. "Cholesterol-independent neuroprotective and neurotoxic activities of statins: perspectives for statin use in Alzheimer disease and other age-related neurodegenerative disorders." Pharmacological research : the official journal of the Italian Pharmacological Society 2011, 64, 3 180-6.

Pocernich, CB ; Lange, ML ; Sultana, R.; Butterfield, DA "Nutritional approaches to modulate oxidative stress in Alzheimer's disease." Current Alzheimer research 2011, 8, 5 452-69.