Former group members

Graduates, Undergraduates, and Postdocs

David Steinberg

david.steinberg@yale.edu David Steinberg (U)

Yale University (B.S.)
Mariela Bollini

mariela.bollini@yale.edu Mariela Bollini (P)

Universidad de Buenos Aires, Argentina (Ph.D.)
Anil Ekkati

aekkati@gamil.com Anil Ekkati (P)

Michigan Technological University (Ph.D.)
Nadia Elizabeth Danford

Nadia Elizabeth Danford (U)

Yale University (B.S.)
Alissa Hare

alissa.hare@yale.edu Alissa Hare (G)

Calvin College (B.S.); Yale University (M.S., Ph.D.)
Postdoctoral Assocciate, California Institute of Technology
Cheryl Leung

cheryl.leung@yale.edu Cheryl Leung (G)

University of California, Berkeley (B.S.); Yale University (M.S., Ph.D.)
Jakub Kostal

jakub.kostal@yale.edu Jakub Kostal (G)

Middlebury College (B.S.); Yale University (M.S., Ph.D.)

john.terhorst@aya.yale.edu John Terhorst (G)

University of Redlands (B.S.); Yale University (M.S., Ph.D.)
Adjunct Professor at Vanguard University, Costa Mesa, CA
Krishna Ravindranathan

krishna.ravindranathan@yale.edu Krishna Ravindranathan (P)

Rutgers University (Ph.D.)
Alex Trofimov

alexander.trofimov@yale.edu Alex Trofimov (P)

Syktyvkar State Univerisity, Russia (B.S.); University of Illinois at Chicago (Ph.D.)
Irix Pharmaceutical

leyla.celik@yale.edu Leyla Celik (P)

Aarhus University (BSc, MSc, & Ph.D.)
Huan Lu

huan.lu@yale.edu Huan Lu (G)

University of Science and Technology of China (B.S.)
Vinay Thakur

vthakur@rib-x.com Vinay Thakur (P)

National Chemical Laboratory, Pune, India (Ph.D.)
Rib-X Pharmaceuticals, Inc.; Senior Chemist

mail@julienmichel.net Julien Michel (P)

ENSCL, France (MChem); University of Southampton, UK (Ph.D.)
University of Edinburgh, Royal Society University Research Fellow, School of Chemistry
James Luccarelli

James Luccarelli (U)

Yale University (B.S.)
Grad. Student, Oxford, UK
Connie Wang

Connie Wang (U)

Yale University (B.S.)
Laura Thomas DeFeo

laura.defeo@aya.yale.edu Laura Thomas DeFeo (G)

Duquesne University (B.S.); Yale University (Ph.D.)
The National Academies/National Research Council (Washington, D.C.), Report Review Committee, Report Review Associate

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

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

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

Florida International University (B.S.); Duquesne University (Ph.D.)
Auburn University, Associate 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
Dapo Babatunde

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

Yale University (B.S.)
New York Presbyterian Hospital, NY

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

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

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

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

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, Scientist 3; University of Texas at Austin, Research Fellow; Journal of J. Chem. Health Safety Editorial Board

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; Professor

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.)
Pfizer
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

gkaminski@wpi.edu George Kaminski (G)

Yale University (Ph.D.)
Associate Professor, Worcester Polytechnic Institute
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&D Boston; Principle Scientist I

patrick.s.lee@gmail.com Patrick S. Lee (P)

UCLA (Ph.D.)
Novartis
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.)
Lyons & Associates, LLC

madura@duq.edu Jeffry Madura (G)

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

mmahoney@cs.stanford.edu Michael Mahoney (G)

Yale University (Ph.D.)
Research Associate, Stanford University Department of Mathematics

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

Yale University (Ph.D.)
Roche/Genentech, Global Studies Manager
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.

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

University of Toronto (M.Sc.); Yale University (Ph.D.)
Kilpatrick Townsend & Stockton LLP

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

mprice@incresearch.com Melissa L. Price (Plount) (G)

Yale University (Ph.D.)
Executive Director, INC Research Strategic Alliances, Oncology

Dan Price (G)

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

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

Yale University (Ph.D.)
Swarthmore College, Professor of Chemistry and Biochemistry

repasky@schrodinger.com Matthew Repasky (G)

University of Miami, B.Sc.; Yale University, Ph.D.
Schrodinger, Inc.; Director, Structure-Based Research

mrichardson@arqule.com Miriam Richardson (G)

Yale University

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

Yale University (Ph.D)
Associate 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

david.spellmeyer@nodality.com David Spellmeyer (U)

Purdue University (B.S.), UCLA (Ph.D.)
Nodality, Inc.
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

marina.udier@novartis.com Marina Udier Blagovic (G)

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

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

Yale University (Ph.D.)
Shanghai Jiao Tong University

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)

Hannes Harbrecht

h.harbrecht@gmail.com Hannes Harbrecht (V)

University of Cambridge, UK (M.Phil)
William DeWitt  Horrocks, Jr.

William DeWitt Horrocks, Jr. (V)

MIT, Ph.D.
Pennsylvania State University, State College, Professor
Valeria LaPietra

valeria.lapietra@unina.it Valeria LaPietra (V)

Nunzio Iraci

Nunzio Iraci (V)

Graduate Student Università di Messina
Arshad Khan

kub@psu.edu Arshad Khan (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 and Department Chair

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
Cristina Tintori

tintori@unisi.it Cristina Tintori (V)

Università degli Studi di Siena,
Prof. Maurizio Botta

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