Chair (2025)
ACS Fellow (2023-)
Lee Woodcock, Ph.D.
University of South Florida
Tampa, FL
hlw_AT_usf.edu
Chair-Elect (2025)
John Herbert, Ph.D.
Ohio State University
Columbus, OH
herbert_AT_chemistry.ohio-state.edu
Immediate Past Chair (2024)
Secretary (2021-2023)
Social Media Chair
Katrina Lexa, Ph.D.
Stealth NewCo
South San Francisco, CA
katrina.lexa_AT_gmail.com
Secretary (2024-2026)
Yihan Shao, Ph.D.
University of Oklahoma
Norman, OK
yihan.shao_AT_ou.edu
Treasurer (2025-2027)
Zhongyue (John) Yang, Ph.D.
Vanderbilt University
Nashville, TN
zhongyue.yang_AT_vanderbilt.edu
Assistant Treasurer (2023-2025)
Xuhui Huang, Ph.D.
University of Wisconsin, Madison
Madison, WI
xhuang_AT_chem.wisc.edu
Councilor I (2024-2026)
Heidi Klem
NIST
Heidi.Klem_AT_nist.gov
Councilor II (2024-2025), Alternate Councilor 2026
Hrant Hratchian
UC Merced
Hhratchian_AT_ucmerced.edu
Councilor III (2025-2027), Past Chair (2022)
Jana Shen, Ph.D.
University of Maryland
Baltimore, MD
Jana.Shen_AT_rx.umaryland.edu
Alternate Councilor I (2023-2025)
Guillaume Lamoureux, Ph.D.
Rutgers University, Camden
Camden, NJ
guillaume.lamoureux_AT_rutgers.edu
Alternate Councilor II (2025-2027)
Ed Brothers, Ph.D.
Gaussian, Inc.
Wallingford, CT
ed_AT_gaussian.com
Alternate Councilor III (2025-2027)
Lyna Luo, Ph.D.
West University of Health Sciences
Pomona, CA
luoy_AT_westernu.edu
Program Co-Chair (2023-)
Alex Dickson, Ph.D.
Michigan State University
East Lansing, MI
alexrdAT_msu.edu
Program Co-Chair (2023-)
Kira Armacost, Ph.D.
GlaxoSmithKline
Philadelphia, PA
kira.x.armacost _AT_gsk.com
Journal of Molecular Graphics & Modelling Editor (COMP Liaison)
Emilio Xavier Esposito, Ph.D.
exeResearch LLC
East Lansing, MI
emilio.esposito_AT_gmail.com
COMP Awards Assoc Coordinator (2024-)
Karl. N. Kirschner, Ph.D.
University of Applied Sciences Bonn-Rhein-Sieg
k.n.kirschner_AT_gmail.com
COMP Awards Coordinator (2023-), Sticker Designer
Robert Paton, Ph.D.
Colorado State University
Fort Collins, CO
robert.paton _AT_colostate.edu
COMP Awards Coordinator (2023-)
Zoe Cournia, Ph.D.
Biomedical Research Foundation
Academia of Athens
Athens, Greece
Bylaws Chair (2024-)
Edward Sherer, Ph.D.
Merck
Rahway, NJ
edward_sherer_AT_merck.com
Newsletter (2024-), Past Chair (2020)
Seonah Kim, Ph.D.
Colorado State University
Fort Collins, CO
Seonah.Kim_AT_colostate.edu
Social Chair (2024-)
Mia Rosenfeld
Iambic Therapeutics
San Diego, CA
mia.rosenfeld_AT_gmail.com
Social Media Coordinator (2022-)
Lauren Raguette
Stony Brook University
Stony Brook, NY
Lauren.Raguette_AT_
stonybrook.edu
Members-at-Large are former COMP Executive Committee members that continued to champion the COMP division and are still active in either the COMP division or the ACS.
Councilor I (2022-2024)
ACS Fellow (2024-)
Christine M. Aikens, Ph.D.
Kansas State University
Manhattan, KS
cmaikens_AT_ksu.edu
ACS Fellow (2010-)
Wendy Cornell, Ph.D.
IBM
Yorktown Heights, NY
cornell_AT_us.ibm.com
Alternate Councilor I (2022-2024)
Colin Lam, Ph.D.
Merck
Kenilworth, NJ
yu.hong.lam_AT_merck.com
Councilor III (2021-2023)
Emilio Gallicchio, Ph.D.
Brooklyn College
Brooklyn, NY
egallicchio_AT_brooklyn.cuny.edu
Past Chair (2024), Undergraduate Programming Chair (2022-2025)
Ashley Ringer McDonald, Ph.D.
Cal Poly
San Luis Obispo, CA
armcdona_AT_calpoly.edu
Program Co-Chair (2024)
Maria Nagan, Ph.D.
Stony Brook University
Stony Brook, NY
maria.nagan_AT_stonybrook.edu
COMP Awards Coordinator (2023)
ACS Fellow (2014-)
Adrian Roitberg, Ph.D.
University of Florida
Gainesville, FL
roitberg_AT_qtp.ufl.edu
Past Secretary
Veerabahu Shanmugasundaram, Ph.D.
Celgene
Cambridge, MA
veerabahu.shanmugasundaram_AT_gmail.com
COMP Awards Coordinator (2023)
ACS Fellow (2016-)
Carlos Simmerling, Ph.D.
Stony Brook University
Stony Brook, NY
carlos.simmerling_AT_stonybrook.edu
Media & Member Relations (2023)
Y. Jane Tseng, Ph.D.
National Taiwan University
Taipei, Taiwan
yjtseng_AT_csie.ntu.edu.tw
Daniel Ortwine
Ortwine Counsulting LLC
Traverse City, MI
dan.ortwine_AT_gmail.com
Treasurer (2022-2024)
Lewis Whitehead, Ph.D.
1910 Genetics
Cambridge, MA
lewisthejust_AT_gmail.com
Our by-laws were voted upon by our COMP membership in August 2022 and ratified by ACS in Octoer 2022.