Former group members

Graduates, Undergraduates, and Postdocs

Zoe Cournia

zcournia@bioacademy.gr Zoe Cournia (P)

National University of Athens (Dipl. Chem.); Ruperto-Carola University of Heidelberg (Ph.D.)
Biomedical Research Foundation of the Academy of Athens, Lecturer

orlando.acevedo@auburn.edu Orlando Acevedo (P)

Florida International University (B.S.); Duquesne University (Ph.D.)
Auburn University, Assistant Professor of Organic Chemistry

balbrecht@loyola.edu Birgit (Biggi) Albrecht (P)

University of Surrey, UK (MChem); University of Oxford (Ph.D.)
Loyola College in Maryland, Assistant Professor of Physical Chemistry

Anastassia Alexandrova (P)

Saratov State University, Russia (B.S./M.S.); Utah State University (Ph.D.)
University of California Los Angeles, Assistant Professor of Physical Chemistry and Postdoctoral Fellow in Professor John Tully's Laboratory, Yale University
Dapo Babatunde

dapo@doctor.chem.yale.edu Dapo Babatunde (U)

Yale University (B.S.)

gabriela.barreiro@yale.edu Gabriela Barreiro (P)

Universidade Federal do Rio de Janeiro, Brazil (M.S.; Ph.D.)

jim.blake@arraybiopharma.com Jim Blake (G)

Purdue University (Ph.D.)
Array BioPharma Inc.; Senior Research Investigator

jbriggs@uh.edu Jim Briggs (G)

Purdue University (Ph.D.)
University of Houston, Associate Professor of Biology and Biochemistry, Chemistry, and Chemical and Biomolecular Engineering; Leader, Division of Biochemistry; VisiGen Biotechnologies, Inc., Co-founder, Vice President, and CFO
J. Kathleen Buckner

J. Kathleen Buckner (G)

Purdue University (Ph.D.)

BURES_MARK@lilly.com Mark Bures (G)

Purdue University (Ph.D.)
Lilly Research Labs, Computational Chemistry, Group Leader

carlsonh@umich.edu Heather Carlson (G)

Yale University (Ph.D.)
University of Michigan, Associate Professor of Med. Chemistry and Chemistry
Theodore (Ted) Christakis

tchristakis@gmail.com Theodore (Ted) Christakis (U)

Yale University (B.S.)

mec@lanl.gov Michael Cournoyer (G)

Purdue University (Ph.D.)
Los Alamos National Laboratory

damm@schrodinger.com Wolfgang Damm (P)

University of Basel (Ph.D.)
Schrodinger, Inc.

duffy@rib-x.com Erin M. Duffy (G)

Yale University (Ph.D.)
Rib-x Pharmaceuticals, Inc.; Vice President, Structure-Based Drug Discovery

J.W.Essex@soton.ac.uk Jonathan Essex (P)

Oxford University (Ph.D.)
University of Southampton; Senior Lecturer

evanseck@duq.edu Jeffrey D. Evanseck (U)

University of California, Los Angeles (Ph.D.)
Duquesne University, Professor
Jan Fleischer

jmfleisc@ius.edu Jan Fleischer (G)

Yale University (Ph.D.)
Indiana University Southeast

toni.frontera@uib.es Antonio Frontera (P)

University of Balearic Islands (Ph.D.)
University of the Balearic Islands
Sunil Gandavadi

gskgrandavadi@yahoo.co.in Sunil Gandavadi (P)

dgao@centralstate.edu Daqing Gao (G)

Yale, (M.Sc.); Boston College, (Ph.D)
Central State University, Wilberforce OH; Assistant Professor

gao@chem.umn.edu Jiali Gao (G)

Purdue University (Ph.D.)
University of Minnesota, Dept of Chemistry; Professor

sgothe@PTCBIO.com Scott Goethe (P)

University of Pittsburgh (Ph.D.)
PTC Therapeutics, Inc.; Senior Scientist

cris@ramana.chem.yale.edu Cristiano Guimarães (P)

Universidade Federal do Rio de Janeiro, Brazil (M.S.; Ph.D.)
Amgen
Alan Gushurst

Alan Gushurst (G)

Purdue University (Ph.D.)
Molecular Design Ltd.

harold_helson@cambridgesoft.com Harold Helson (G)

Purdue University (Ph.D.)
CambridgeSoft Inc., Senior Computational Chemist
Iordanis Houdaverdis

Iordanis Houdaverdis (G)

Yale University (Ph.D.)
Derrick Howard

derrick.howard@yale.edu Derrick Howard (U)

Yale University 2003, B.Sc.
American Express

kasper.jensen@yale.edu Kasper Planeta Jensen (P)

Lund University (Ph.D.)

Corky Jenson ()

Yale University
Hongyu Jiang

Hongyu Jiang (G)

Yale University (M.Sc.); Peking University, Beijing (B.S.)

Deborah.K.Jones-Hertzog@gsk.com Debbie K. Jones-Hertzog (P)

Emory University (Ph.D.)
GlaxoSmithKline ; Site Head and Director Cheminformatics, RTP

kamin1ga@cmich.edu George Kaminski (G)

Yale University (Ph.D.)
Central Michigan University; Assistant Professor
Joseph T. Kim

josephkim12@gmail.com Joseph T. Kim (P)

University of Illinois at Chicago (Ph.D.)
Post-Doctoral Fellow in Chemistry and Chemical Biology, Harvard University

ingvar@accelrys.com Ingvar Lagerstedt (P)

Chalmers University of Technology, Gothenburg, Sweden (Ph.D)
Accelrys; Senior Scientist

ellen.laird@arraybiopharma.com Ellen Laird (G)

Purdue University (Ph.D.)
Array BioPharma Inc.; Senior Research Investigator

Michelle.Lamb@astrazeneca.com Michelle Lamb (G)

Yale University (Ph.D.)
AstraZeneca R& Boston; Computational Chemist

patrick.s.lee@yale.edu Patrick S. Lee (P)

UCLA (Ph.D.)
SGX Pharmaceuticals, Inc.; San Diego, CA
Siegfried Leung

siegfried.leung@ucsf.edu Siegfried Leung (G)

University of San Francisco (B.S.); Yale University (Ph.D.)
Postdoctoral Associate, Laboratory of Professor Matt Jacobson, UCSF

dclim@lgls.co.kr Dongchul Lim (GP)

Seoul National Univ.(BS), Yale Univ (Ph.D.)
LG Life Sciences, Korea; Manager
Rong Liu

yaya60025@yahoo.com Rong Liu (G)

Yale University (Ph.D.)
Cap Gemini; Oracle DBA

theresa@theresamlyons.com Theresa Lyons (G)

Hobart and William Smith Colleges (B.S.); St. John's University (M.S.); Yale University (Ph.D.)
Postdoctoral Fellow at Sanofi-Aventis (N.J)

madura@duq2.cc.duq.edu Jeffry Madura (G)

Purdue University (Ph.D.)
Duquesne University; Professor

michael.mahoney@yale.edu Michael Mahoney (G)

Yale University (Ph.D.)
Yale University, Gibbs Assistant Professor

fenglou@csbl.bmb.uga.edu Fenglou Mao (P)

Peking University (Ph.D.)
University of Georgia
Dave Maxwell

david.maxwell@di.mdacc.tmc.edu Dave Maxwell (G)

Yale University (Ph.D.)
University of Texas M.D. Anderson Cancer Center, Senior Research Scientist
Nora McDonald

NORA.MCDONALD@ROCHE.COM Nora McDonald (G)

Yale University (Ph.D.)
Hoffman-LaRoche, Inc
David McLaughlin

David McLaughlin (G)

Kodak Inc.
Pascal Metivier

pascal.metivier@eu.rhodia.com Pascal Metivier (P)

Rhodia Asia Pacific, Vice President R&D director

tnguyen@coleypharma.com Toan Nguyen (G)

Yale University (Ph.D.)
Coley Pharmaceutical Group, Inc.

sara.nichols@gmail.com Sara Nichols (G)

New York University (B.A.); Yale University (Ph.D.)
Postdoctoral Associate, Laboratory of Professor Andrew McCammon, UCSD

denis.ostrovsky@gsk.com Dennis Ostrovsky (G)

University of Toronto (M.Sc.); Yale University (Ph.D.)
GlaxoSmithKline; Principal Scientist

gigi.paderes@pfizer.com Gigi Paderes (G)

Yale University (Ph.D.)
Pfizer, Inc., Senior Principal Scientist
Shoshanna Pearlman

shoshannahnj@hotmail.com Shoshanna Pearlman (G)

Swarthmore College, B.Sc.; Yale University, M.Sc.

Catherine.E.Peishoff@gsk.com Catherine Peishoff (G)

Purdue University
SmithKline Beecham Pharmaceuticals; Site Director, Computational, Analytical, and Structural Sciences

jpranata@comp.uark.edu Julian Pranata (P)

CalTech
University of Arkansas

Al_Pierce@vpharm.com Albert Pierce (G)

Yale University (Ph.D.)
Vertex Pharmaceuticals

price@attenuon.com Melissa L. Price (Plount) (G)

Yale University (Ph.D.)
Attenuon, L.L.C.; Research Scientist

Dan Price (G)

Yale University (Ph.D.)
Postdoctoral Associate; Laboratory of Professor Charles L. Brooks, III

prablen1@swarthmore.edu Paul R. Rablen (P)

Yale Univ (Ph.D.)
Swarthmore College

repasky@schrodinger.com Matthew Repasky (G)

University of Miami, B.Sc.; Yale University, Ph.D.
Schrodinger, Inc.; Scientific Developer

mrichardson@arqule.com Miriam Richardson (G)

Yale University

rizzo@ams.sunysb.edu Robert Rizzo (G)

Yale University (Ph.D)
Assistant Professor, SUNY Stony Brook
Juliana Ruiz-Caro

juliana.ruiz-caro@yale.edu Juliana Ruiz-Caro (P)

Univ. Complutense de Madrid (Ph.D.)
Max-Planck-Institut, Mülheim an der Ruhr (Postdoc)

salatit@basf-corp.com Timothy Salatin (G)

Purdue University
BASF Coatings AG,Industrial Coatings Soulutions, Director, Global Technology
Kurt W. Sattelmeyer

sattlmyr@ramana.chem.yale.edu Kurt W. Sattelmeyer (P)

University of Georgia (Ph.D.)

wshaffer@uclink4.berkeley.edu Wendy Shaffer (U)

Yale University (B.S.)
Graduate Student, UC Berkeley
Shane Shariffskul

s-shariffskul@northwestern.edu Shane Shariffskul (U)

Yale University (B.S.)

dseverance@kalypsys.com Dan Severance (GP)

Purdue University (Ph.D.)
Kalypsys, Inc, Associate Director

sheena.sinclair@usa.dupont.com Sheena Sinclair (G)

Yale Univ (Ph.D.)
DuPont

dspell@us.ibm.com David Spellmeyer (U)

Purdue University (B.S.), UCLA (Ph.D.)
IBM Almaden Research Center
Carol Swenson

Carol Swenson (P)

yukio@nyssa.chem.yale.edu Yukio Tominaga (P)

Osaka University (Ph.D.)
Dainippon Pharmaceutical
Vickie Tsui

vtsui@gene.com Vickie Tsui (U)

The Scripps Research Institute
Genentech, Inc.; Scientist

ivan@tubert.org Ivan Tubert-Brohman (G)

Yale University (Ph.D.)
Senior Scientist, Schrodinger, LLC

Marina_Udier-Blagovic@mckinsey.com Marina Udier Blagovic (G)

Yale University (Ph.D.)
Strategic Marketing Group, Novartis Pharma

jakob@doctor.chem.yale.edu Jakob Ulmschneider (G)

Yale University (Ph.D.)

Willem_Van_Hoorn@sandwich.pfizer.com Willem P. van Hoorn (P)

University of Twente, Enschede, the Netherlands (Ph.D.)
Pfizer, Inc. (UK)

dwang@rib-x.com Deping Wang (P)

Hong Kong University of Science and Technology (Ph.D.)
Rib-x Pharmaceuticals, Inc.; Research Scientist

edwatkins@mena.chem.yale.edu Edward Watkins (P)

Pennsylvania State University (Ph.D.)
Amgen (Rhode Island)

Steven.Wesolowski@astrazeneca.com Steve S. Wesolowski (P)

University of Georgia (Ph.D.)
AstraZeneca Pharmaceuticals; Senior Scientist and Group Leader
Zheren (James) Yang

zheren.j.yang@gmail.com Zheren (James) Yang (U)

Yale University (B.S.)

weiya.yun@roche.com Weiya Yun (G)

Hoffmann-La Roche, Inc., Senior Principal Scientist
Jaco Zeevaart

JZeevaart@wildflavors.com Jaco Zeevaart (P)

Senior Scientist, Wild Flavors Co., Ltd.

Esteemed Visitors

rbatra@gmx.net Rohit Batra (V)

University of Basel, Switzerland
University of Basel, Switzerland

bernard.bigot@cea.fr Bernard Bigot (V)

Atomic Energy High Commissioner (France)
Luciene Borges

lubosi@terra.com.br Luciene Borges (V)

Postdoc with Professor Ribeirao Preto
Simone Fulle

Simone Fulle (V)

Graduate Student Uni Frankfurt
Jan Haak

Jan Haak (V)

William DeWitt  Horrocks, Jr.

William DeWitt Horrocks, Jr. (V)

MIT, Ph.D.
Pennsylvania State University, State College, Professor
Nunzio Iraci

Nunzio Iraci (V)

Graduate Student Università di Messina
Arshad Kahn

Arshad Kahn (V)

Pennsylvania State University, DuBois

hskim@mail.ulsan-c.ac.kr Hag-Sung Kim (V)

Kyungpook National University (Ph.D.); Work: Ulsan College, Korea
Ulsan College, Korea; Professor

Tooru Matsui (V)

Matsushita, Osaka, Japan

modesto@luz.bq.ub.es Modesto Orozco (V)

parc Cientific de Barcelona & Universitat de Barcelona, Spain; Professor of Biochemistry

vpeuch@chimie.ens-lyon.fr Vincent Peuch (V)

Graduate Student, Ecole Normale Superieure de Lyon, France
Abdel Rawashdeh

rawash65401@yahoo.com Abdel Rawashdeh (V)

Missouri University of Science and Technology (Ph.D.)
Assistant Professor at Yarmouk University, Jordan
Massimo Selmi

Massimo Selmi (V)

Graduate Student, Italy

fvv@uvic.ca Frank van Veggel (V)

University of Twente, The Netherlands (Ph.D.)
University of Victoria, Professor in Chemistry and Canada Research Chair in Supramolecular Photonic Materials