Extended Truhlar group, collaborators,

and former group members

Departmental alumni pages: U of M Chemistry Alumni

Extended Truhlar group: A B C D E F G H I J K L M N O P Q R S T U V W X Y Z

Joseph Abdallah, Jr. Los Alamos National Laboratory Los Alamos, NM abd@lanl.gov
Najib Abusalbi Schlumberger Well Services Houston, TX 77001
Christine M. Tratz Aikens Northwestern University Chicago, IL c-akiens@northwestern.edu	1999
Cristobal Alhambra Astra Zeneca Pharmaceuticals Wilmington, DE Cristobal.Alhambra@astrazeneca.com
Titus V. Albu Tennessee Technological University Cookeville, TN albu@tntech.edu	2002
Thomas C. Allison National Institute of Standards and Technology Gaithersburg, MD allison@dirac.nist.gov	2004
Dmitry Altshuller Scientific Applications and Research Associates, Inc Cypress, CA www.sara.com daltshuller@sara.com
Elizabeth Ambrose Amin University of Minnesota Minneapolis, MN eamin@umn.edu	2006
Amos Anderson Caltech Pasadena, CA 91125 amosa@caltech.edu	2003
XavierAssfeld Universite Henri Poincare Nancy, France Xavier.Assfeld@lctn.u-nancy.fr	2004

Steven Bachrach Trinity University San Antonio, TX bachrach@trinity.edu	2003
Kim Baldridge San Diego Supercomputer Center San Diego, CA kimb@scsc.edu	2003
Sudeep Bhattacharyay University of Wisconsin Eau Claire, WI bhattacharyay@uwec.edu
Maynard Brandt Cray Inc. (retired) Eagan, MN mabrandt@mac.com	2003
Joe Brom University of St. Thomas St. Paul, MN jmbrom@stthomas.edu	2001
Dean Briesemeister
Frank Brown Tallahassee Community College Tallahassee, FL BROWNF@tcc.fl.edu

Luis Campos U.C.L.A. Los Angeles, CA lcampos@chem.ucla.edu	2006
Arindam Chakraborty Department of Chemistry Pennsylvania State University University Park, PA 16802
Adam Chamberlin
Candee Chambers Mercyhurst College Erie, PA chambers@mercyhurst.edu	2003
David Chatfield Florida International University Miami, FL chatfiel@fiu.edu	2003
James R. Chelikowsky University of Minnesota Minneapolis, Minnesota 55455 jrc@msi.umn.edu	2003
Yao-Yuan Chuang National Chiayi University Kaohsiung, Taiwan yaoyuan_chuang@yahoo.com	2004
Steven M. Clayton
Laura Clemens
David Cochrane
E. Laura Coitiño Centro Universitario de Malvin Norte Montevideo, Uruguay laurac@fcien.edu.uy	2003
Michael Collins
Jose C. Corchado Univesidad de Extremadura Badajoz, Spain corchado@unex.es	2003
Christopher J. Cramer University of Minnesota Minneapolis, MN cramer@umn.edu	1997

Erin Dahlke Loras College Dubuque, IA erin.dahlke@loras.edu	2007
Joseph Danzer
Paul Day Wright-Patterson Air Force Base Dayton, OH daypn@biotech.ml.wpafb.af.mil
Derek Dolney University of Pennsylvania Philadelphjia, PA dolney@student.physics.upenn.edu	2003
Haozhe Dong University of Minnesota Minneapolis, MN
Dr. R. J. Duchovic Indiana University-Purdue University Fort Wayne
James W. Duff Spectral Sciences, Inc. Burlington, MA
Fred Dulles University of Minnesota Minneapolis, MN dulles@umn.edu	2000
Csilla Duneczky Johnson County Community College Overland Park, KS
Thomas H. Dunning, Jr. University of Tennessee Knoxville, TN	2003
Michel Dupuis Pacific Northwest National Laboratory Richland, WA michel.dupuis@pnl.gov	2003
Agnieszka Dybala-Defratyka Technical University of Lodz Lodz, Poland	2004
Kenneth Dykema Department of Mathematics Texas A&M University College Station, TX

Robert A Eades IBM Cincinati, OH raeades@us.ibm.com
Timothy Ebner Dept. Of Neuroscience University of Minnesota Minneapolis, MN ebner001@umn.edu
Benjamin Ellingson OpenEye Scientific Software Santa Fe, NM 87507 ben@eyesopen.com	2007
Natalie Elmasry
Joaquin Espinosa Garcia Universidad de Extremadura Badajoz, Spain joaquin@unex.es

Patton Fast Senior Account Manager InforSense LLC 25 Moulton Street Cambridge, MA 02138 USA Telephone: +1 617 547 2500 Mobile: +1 651 261 9541 Fax: +1 617 547 2772 Email: pfast@inforsense.com	2004
Antonio Fernandez-Ramos Universidade de Santiago de Compostela Santiago de Compostela, Spain qftramos@usc.es	2004
Gerald T Fraser National Institute of Standards and Technology Gaithersburg, MD gerald.fraser@nist.gov	2003
Ronald S. Friedman Indiana University-Purdue Fort Wayne, Indiana friedman@hilbert.ipfw.edu
Michael Frisch Gaussian, Inc. frisch@gaussian.com

Annia Galano Universidad Autonoma Metropolitana-Iztapalapa San Rafael Atlixco 186, Col. Vicentina, Iztapalapa, C. P. 09340 Mexico D. F., Mexico agalano@prodigy.net.mx	2008
Jiali Gao University of Minnesota Minneapolis, MN jgao@umn.edu	2004
Mireia Garcia-Viloca Universitat Autonoma de Barcelona Bellaterra (Barcelona), Spain mireia@ibb.uab.es	2002
BruceC. Garrett Pacific Northwest National Laboratory Richland, WA bruce.garrett@pnl.gov	2003
Thomas Georgian New York, NY
David J. Giesen Kodak Rochester, NY giesen@kodak.com	2004
Steven Girshick Dept. of Mechanical Engineering University of Minnesota, Minneapolis, MN slg@umn.edu
Jason Goeppinger
Núria González-García Universitat Autònoma de Barcelona Bellaterra (Barcelona) SPAIN nuria@qf.uab.es	2003
Angels Gonzalez Lafont Universitat Autonoma de Barcelona Bellaterra (Barcelona), Spain angels@klingon.uab.es	2004
Mark Gordon Iowa State University Ames, IA mark@si.fi.ameslab.gov	2003
Joni Gray Univ. of Minnesota Minneapolis, MN	2005
Roger Grev Chemical Abstracts Service Columbus, OH rgrev@cas.org
Michael Zhen Gu Massachusetts Institute of Technology Cambridge, MA zgu@mit.edu

Michael Hack Johnson and Johnson La Jolla, CA MHack@PRDUS.JNJ.COM	2004
Ian Haken University of North Texas Denton, Texas 76203-5070 irh0001@unt.edu	2005
Philippe Halvick University of Bordeaux Talence, France p.halvick@lpcm.u-bordeaux1.fr
Gene Hancock Northern States Power Minneapolis, MN
Maegan Harris Department of Chemistry University of Minnesota	1999
Nancy Mullaney Harvey Computer Sciences Corporation Chicago, IL nharvey@csc.comp
Kenneth Haug Lafayette College Easton, PA haugk@lafayette.edu	2004
Gregory D. Hawkins SAP America, Inc. Minneapolis, MN gregory.hawkins@sap-ag.de
Andreas Heyden University of South Carolina Columbia, SC	2007
Andrew Holder Semichem, Inc. Shawnee Mission, KS holdera@umkc.edu	2003
Charles J. Horowitz Indiana University Bloomington, IN	2003
Wei-Ping Hu Department of Chemistry and Biochemistry National Chung Cheng University Chia-Yi, Min-Hsiung Taiwan 621 chewph@ccu.edu.tw	2005
Darrell Hurt

Dr. Sonia Ilieva Department of Chemistry University of Sofia 1 James Bourchier Ave. 1164 Sofia Bulgaria Tel: +359-2-8161-211 Fax:+359-2-9625-438 E-mail: silieva@chem.uni-sofia.bg	2005
Mark A. Iron Computational Chemistry Unit Department of Chemical Research Support Weizmann Institute of Science Rehovot, Israele 76100	2007
Alan Isaacson Miami University Miami, OH ISAACSON@MIAVX1.ACS.MUOHIO.EDU	2003
Grant Izmirlian	2003

Charles F. Jackels University of Washington Bothell, WA jackels@u.washington.edu	2003
Pablo Jaque Pontificia Universidad Catolica de Chile	2006
Ahren Jasper Combustion Research Facility Sandia National Laboratories Livermore, CA ahrenjasper@gmail.com	2004
Kara Johnson Stanford University Stanford, CA karaj@stanford.edu	2005
Tomi Joseph
Sutjano Jusuf	1995

Martine Kalke
John A. Keith Calif. Inst. of Technology Pasadena, CA johnk@wag.caltech.edu	2004
Casey Kelly Procter & Gamble, Inc. Cincinnati, OH
Nancy Kilpatrick
Yongho Kim Kyung Hee University Yongin-City, Kyunggi-Do, 449-701 Korea yhkim@nms.kyunghee.ac.kr	2003
Amnon Kohen University of Iowa Iowa City, IA amnon-kohen@uiowa.edu	2003
Donald J. Kouri University of Houston Houston, TX kouri@kitten.chem.uh.edu	2003
Alex Kozin University of Minnesota
Kathleen Kuhler Visiting Assistant Professor Baylor University Kathy_Kuhler@baylor.edu
Aron Kuppermann Caltech Pasadena, CA aron@caltech.edu	2003
Keith Kuwata Macalester College kuwata@comp.chem.umn.edu	2004

Jason Lang	1997
Jack Lauderdale
John Le Department of Electrical Engineering University of Minnesota Minneapolis, MN john@ece.umn.edu
Jill Leas Yale University leasj@purdue.edu	2003
Hyunju Lee Darrin York Group University of Minnesota	2007
Jiabo Li Accelrys San Diego, CA jli@msi.com	1998
Zhen Hua Li Fudan University Shanghai, China zhenhuali2004@gmail.com	2007
Carmay Lim Academia Sinica Taipei, Taiwan carmay@gate.sinica.edu.tw	2004
Hai Lin University of Colorado at Denver Denver, CO	2004
Tiqing Liu University of Maryland College Park, MD liut@umbi.umd.edu	2003
Yi-Ping Liu Newport VT
Da-hung Lu Fitchburg State College Fitchburg, MA dlu@fscvax.fsc.mass.edu
Benjamin Lynch Minnesota Supercomputing Institute Minneapolis, MN blynch@msi.umn.edu	2004
Vanessa Audette Lynch Roseville, MN audette@t1.chem.umn.edu vanessamlynch@yahoo.com	2004
Gillian Lynch University of Houston Houston, TX glynch@uh.edu	2003

Alan W. Magnuson
Jan M.L. Martin Weizmann Institute of Science Rechovot, ISRAEL comartin@wicc.weizmann.ac.il	2003
Laura Masgrau Fontanet Department of Biochemistry University of Leicester University Road Leicester LE1 7RH, UK	2004
David R. Maurice Q-Chem, Inc. Export, PA
C. Alden Mead Savannah, GA	2004
Vasilios Melissas Department of Chemistry University of Ioannina GR-451 10 Ioannina Greece Tel: ++3026-5109-8471 Fax: ++3026-5109-8682 E-mail: melissas@chem.auth.gr	2003
Jean A. Merrick Polymer Chemistry Group, Conoco Ponca City, OK
Thomas F. Miller University of Oxford Oxford, UK thomas.miller@balliol.oxford.ac.uk	2004
Mirjana Mladenovic Universitaet Goettingen Goettingen, Germany mmladen@gwdg.de
Jerry Mohrig	2000
Bill Moldestad	2005
Francesc Molins University of Minnesota Department of Chemistry cesc@chem.umn.edu	2006
Robert Molt	2007

Hisao Nakamura Department of Chemical System Engineering University of Tokyo Tokyo 113-8656, Japan nakamura@tcl.t.u-tokyo.ac.jp	2004
Masato Nakamura Nihon University Narashino-dai Funabashi, Japan	2005
Tonny Nam
Shikha Nangia 104 Chemistry Building, Department of Chemistry, Pennsylvania State University, University Park, PA 16802 sxn219@psu.edu
Shivangi Nangia Department of Chemistry, Pennsylvania State University, University Park, PA 16802 shivangi@t1.chem.umn.edu	2005
William Necoechea Bergen County School System Belleville, New Jersey billnec@yahoo.com
Kiet Nguyen Wright-Patterson Air Force Base Dayton, OH Kiet.Nguyen@afrl.af.mil
Amanda Nienow née Wensmann Department of Chemistry Gustavus Adolphus College St. Peter, MN anienow@gustavus.edu	1999
Amber Nolan University of Minnesota nola0069@umn.edu
Molli Noland	1998
Robert Numrich University of Minnesota Minneapolis, MN rwn@sgi.com	2003

Radley W. Olson
Ryan Olson Cray, Inc. Mendota Heights, MN	2007
Kunizo Onda Science University of Tokyo Hokkaido, Japan
Michelle Orthmeyer	2006

Piotr Paneth Technical University of Lodz Lodz, Poland paneth@ck-sg.p.lodz.pl	2004
Jiayun Pang Sutcliffe's group University of Manchester Manchester, UK	2005
Yuan-Ping Pang Mayo Clinic College of Medicine Rochester, MN pang@mayo.edu
Richard A. Partridge
Jose Javier Ruiz Perna	2004
Piotr Piecuch Michigan State University East Lansing, Michigan 48824 piecuch@chemistry.msu.edu
Ruth Poling
Tina Poulsen Novo Nordisk Copenhagen, Denmark tinadp@get2net.dk	2002
Larry Pratt Fisk University Nashville, TN lpratt@fisk.edu
Thomas Preston University of Maine Orono, Maine Thomas_Preston@umit.maine.edu	2005
Jingzhi Pu Department of Chemistry and Chemical Biology Harvard University 12 Oxford Street Cambridge, MA 02138 Office: Converse Lab B21 Tel: 617-495-8997 E-mail: pu@tammy.harvard.edu	2005

Mala Radhakrishnan Wellesley College Wellesley, MA 02481 mradhakr@wellesley.edu	2005
Sachchida N. Rai North-Eastern Hill Univerity Shillong, India snrai@nehus.ren.nic.in	2004
Bala "Ramu" Ramachandran Louisiana Tech University Ruston, LA ramu@coes.latech.edu	2004
Rick Randall
Melissa Reeves Tuskegee University Tuskegee, AL mreeves@tuskegee.edu
Brian P. Reid Allegheny College Meadville, PA
Paul Rejto Agouron Pharmaceuticals San Diego, CA
Orlando Roberto-Neto Centro Tecnico-Aeroespacial Sao Jose dos Campos, Brazil CEP 12231-970 orlando@ieav.cta.br	2004
Greg Rodgers Osmetech Molecular Diagnostics Rockland, MA greg.rodgers@osmetech.com
Jocelyn Rodgers University of Maryland College Park, MD jrodgers78@hotmail.com	1999
Ivan Rossi CIRB Biocomputing Unit Bologna, Italy ivan@biocomp.unibo.it
Michal Rostkowski	2005;
John R. Rumble National Institute of Standards and Technology Gaithersburg, MD john.rumble@nist.gov
Keith Runge University of Florida Gainesville, FL runge@qtp.ufl.edu

Yousef Saad Department of Computer Science and Engineering University of Minnesota Minneapolis, MN
Maria Luz Sánchez Universidad de Extremadura Badajoz, Spain mariluz@unex.es
Gregory Schenter Environmental Molecular Sciences Laboratory Richland, VA greg.schenter@pnl.gov
Brian Schmitz Questar Data Systems, Inc. Eagan, MN
Nate Schultz 3M Inc. St. Paul, MN neschultz@mmm.com	2006
Eric Schwegler Lawrence Livermore National Laboratory Livermore, CA schwegler1@llnl.gov
David W. Schwenke NASA Ames Lab Moffett field, CA schwenke@pegasus.arc.nasa.gov	2004
Ahmed S. Shalabi Benha University Benha, Egypt asshalabi@hotmail.com
Yihan Shao Q-Chem, Inc. The Design Center, Suite 690 5001 Baum Blvd. Pittsburgh, PA 15213 yihan.shao@gmail.com	2007
Omar Sharafeddin The Cooper Union for the Advancement of Science and Art New York, NY
Yaakov Shima Soreq Nuclear Research Center Yavne, ISRAEL, 81800
J. Ilja Siepmann University of Minnesota Minneapolis, MN siepmann@umn.edu	2006
Kevin A. Silverstein Compuational Biology Center University of Minnesota silve023@tc.umn.edu
Jake Sirek sire0016@umn.edu	2006
Rex T. Skodje University of Colorado Boluder, CO skodje@spot.colorado.edu	2004
Richard L. Smith
Carly Sodahl
Sarom Sok
Timothy M. Sonbuchner Guastavus Adolphus College St. Peter, MN tsonbuch@gac.edu
Mirek Sopek MakoLab - Computer Graphics Laboratory Lodz, Poland sopekmir@makolab.pl
James A. Sorensen University of Wisconsin-Madison Madison, WI
Anastassia Sorkin University of Minnesota Minneapolis, MN	2007;
Clayton Spencer Illinois College cfspence@hilltop.ic.edu	2004
Beth Sponholtz
Jay Srinivasan Computational Systems Group National Energy Research Scientfic Computing Division Lawrence Berkeley National Laboratory Berkeley, CA jay@penrhiw.org
Grazyna Staszewska Nicolas Copernicus University Torun, Poland grasta@phys.uni.torun.pl	2003
Przemyslaw F. Staszewski Medical School Bydgoszcz, Poland przemek@phys.uni.torun.pl	2003
Sam Stechmann Courant Institute, New York University New York, NY snstechmann@stthomas.edu	2002
Rozeanne Steckler Oregon State University Corvallis, OR steckler@nacse.org	2003
James J. P. Stewart 15210 Paddington Circle Colorado Springs, CO 80921 MrMOPAC@OpenMOPAC.net	2005
Joey W. Storer The Dow Chemical Company Midland, MI jstorer@dow.com
Peifeng Su Xiamen University Xiamen, China supi@xmu.edu.cn	2007
Yan Sun Harvard College Observatory Cambridge, MA
Brian Sutcliffe University of York York, United Kingdom	2006
Zoran Svetlicic Organic, Inc. San Francisco, CA zoran@organic.com

William D. Tarara
Iva Tatic Molecular Modeling Laboratory PLIVA d.d., Research & Development HR-10000 Zagreb, Croatia iva.tatic@pliva.hr
Gregory Tawa Wyeth Research CN 8000 Princeton, NJ 08543 732-274-4120 tawag@wyeth.com
Gregg Taylor
Dan Theis Chemistry Department, University of North Dakota Grand Forks, ND theis@comp.chem.umn.edu	2005
Devarajan Thirumalai University of Maryland College Park, MD dt5@mail.umd.edu	2002
David D. Thomas University of Minnesota Biochemistry and Biophysics Minneapolis, MN http://ddt.biochem.umn.edu/
Don Thompson University of Missouri at Columbia Columbia, Missouri http://www.chem.missouri.edu/Thompson/ thompsondon@missouri.edu
Todd Thompson Nu Music Northfield, MN
Jason Thompson Mayo Clinic Rochester, MN	2004
Maria Topaler Citibank Palinview, NY mtopaler@sprynet.com
Robert Q. Topper Monmouth University West Long Branch, NJ rtopper@monmouth.edu	2004
Thanh Truong Univeristy of Utah Salt Lake City, UT truong@chemistry.chem.utah.edu	2003
Susan Tucker University of California Davis, CA sctucker@ucdavis.edu	2003

Michael Unekis Cargill, Inc. Minnetonka, MN Michael_Unekis@cargill.com

Marat Valiev Environmental Molecular Sciences Laboratory Richland, VA marat.valiev@pnl.gov
Steven M. Valone Los Alamos National Laboratory Los Alamos, NM	2004
Antonio J. C. Varandas Universidade de Coimbra, Coimbra, Portugal varandas@qtvs1.uc.pt	2004
Jordi Villa IMIM/UPF: Grup de Recerca en Informatica Biomedica Barcelona, Spain jvilla@imim.es	2003
Yuri Volobuev IBM Austin, TX volobuev@comp.chem.umn.edu

Carston R. Wagner Department of Medicinal Chemistry University of Minnesota Minneapolis, MN wagner003@umn.edu
Charles A. Weatherford Florida A&M University Tallahassee, FL weatherf@cennas.nhmfl.gov	2005
Liqiang (John) Wei ITAMP Harvard Cambridge, MA	2004
Andrew Welch
Renata Wentzcovich Dept. of Chemical Engineering and Materials Science University of Minnesota Minneapolis, MN wentzcov@cems.umn.edu	2006
George Wilcox University of Minnesota, Department of Neuroscience Minneapolis, MN http://www.neurosci.umn.edu/faculty/wilcox.html george@med.umn.edu	2005
Brian Williams Bucknell University Lewisburg, PA williams@mail.bucknell.edu
Angela Wilson University of North Texas Denton, Texas 76203-5070 akwilson@unt.edu	2000
Paul Winget Ecosystems Research Division National Exposure Research Laboratory US. Environmental Protection Agency 960 College Station Road Athens, GA 30605 Telephone: 706-355-8271 email: Winget.Paul@epa.gov	2004
Steven Wonchoba U. S. West Minneapolis, MN swoncho@uswest.com

James Xidos University of Manitoba Winnipeg, Manitoba R3T 2N2 Canada xidos@cc.umanitoba.ca	2004
Jianhua Xing Department of Biological Sciences Virginia Polytech Institute and the State University Email:jhxing002@yahoo.com

Jonathan Young	2007
Neil Young	2006
Chin-Hui Yu National Tsing Hua University Hsinchu, Taiwan, R.O.C. chyu@hydrogen.chem.nthu.edu.tw

Michael Zachariah University of Maryland College Park, MD mrz@umd.edu
John Z. H. Zhang New York University New York, NY zhang@risc.nyu.edu	2005
Charlie Qi Zhang Lockheed Martin Sunnyvale, CA charlie.q.zhang@lmco.com
Yici Zhang Shandong Teachers University Jinan, Peoples Republic of China
Yuan Zhang Department of Chemistry University of Connecticut 55 North Eagleville Road, Unit 3060 Storrs, CT 06269 yuan.zhang@uconn.edu	2006
Meishan Zhao The James Frank Institute and Department of Chemistry University of Chicago Chicago, IL 60637	1996
Xin Gui Zhao Hughes Electronics, Inc. El Segundo, CA
Chaoyuan Zhu Institute of Molecular Science Department of Applied Chemistry National Chiao Tung University Hsinchu, Taiwan 300 cyzhu@mail.nctu.edu.tw	2004
Tianhai (Tony) Zhu Accelrys San Diego, CA tzhu@msi.com
Eve Zoebisch Riparian Software Los Altos, CA 94024	2001
Dale E. Zurawski

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