Division of Computers in Chemistry: Call for Abstracts

Submission Deadline: Monday, March 31 2025

Program Chair(s): Alex Dickson, Henry Woodcock, Kira Campbell

Note: Submission deadlines are at 11:59 EST on the day posted. Symposia, organizers and deadlines are subject to change. Last updated April 18, 2025.

Title Type Submission Type Organizer Cosponsor Description
Advances in Free Energy Methods (Invited) Oral Invited
CCG Poster Session Poster Contributed
Chemical Reaction Networks, Retrosynthesis, and Reaction Prediction Oral Contributed Predicting the behavior of reacting systems is a core challenge in chemistry. In the forward directi...
Coarse-Grained Modeling for Molecular and Formulation Design (Invited) Oral Invited Coarse-grain modeling represents a cutting-edge approach in both drug discovery and formulation. By ...
COMP Poster Session Poster Contributed
Computational and Machine Learning Approaches to RNA-targeted Small Molecule Drug Design Oral Contributed Small molecule drug designs of RNA based therapeutics is an area of growing interest. Undruggable pr...
Deep Dives in Drug Discovery: Focus on Peptidomimetics Oral Contributed
Deep Dives in Drug Discovery: GLP-1 Agonists Oral Contributed
Drug Design Oral Contributed
Dynamic Polymer Networks: Understanding Adaptive Materials using Data-Driven Experimental Design, Representation and Theory Oral Contributed Polymer networks with dynamic junction chemistries that rely on non-covalent, supramolecular, and dy...
Dynamic Polymer Networks: Understanding Adaptive Materials using Data-Driven Experimental Design, Representation and Theory Poster Contributed Polymer networks with dynamic junction chemistries that rely on non-covalent, supramolecular, and dy...
History of Quantum Chemistry Oral Contributed 100 years of quantum science
History of Quantum Chemistry Poster Contributed 100 years of quantum science
Machine Learning in Chemistry Oral Contributed
Materials Science Oral Contributed
Molecular Mechanics Oral Contributed
Nvidia GPU Award Poster Contributed
OpenEye Cadence Molecular Sciences Outstanding Junior Faculty Award (Invited) Oral Invited
OpenEye Cadence Molecular Sciences Outstanding Junior Faculty Award Poster Contributed
Peter Kollman's Impact on Molecular Modeling: From Hydrogen Bonds to Drug Discovery (Invited) Oral Invited This symposium honors the legacy of Peter Kollman, bringing together Kollman lab alumni and leaders ...
Quantum Mechanics Oral Contributed
Recent Advances in Design, Mechanism and Drug Discovery Toward Oligonucleotide-Based Therapeutics (Invited) Oral Invited
Shaping the Future of Medicinal Chemistry with Machine Learning (Invited) Oral Invited Active learning is a common technique applied in data science to problems where data is limited or e...
WebMO: The First 25 Years (Invited) Oral Invited
Wiley Poster Session Poster Contributed
Peter Kollman's Impact on Molecular Modeling: From Hydrogen Bonds to Drug Discovery Poster Contributed This symposium honors the legacy of Peter Kollman, bringing together Kollman lab alumni and leaders ...