Division of Computers in Chemistry: Call for Abstracts

Submission Deadline: Monday, March 25, 2019

Program Chair(s): Henry Woodcock, Jana Shen

Note: Submission deadlines are at 11:59 EST on the day posted. Symposia, organizers and deadlines are subject to change. Last updated May 28, 2020.

Title    Type    Submission Type Organizer Cosponsor Description
Women Make COMP Oral Contributed
    Women are under-represented in science, with a gender-gap particularly evident in the fundamental sc...
    Wiley Computers in Chemistry Outstanding Postdoc Award Poster Contributed
      Use of Predictive Computational ADME Tools to Enable Drug Discovery Oral Invited
        In the course of drug discovery projects, medicinal chemists must invariably optimize ADME propertie...
        Sci-Mix Poster Contributed
          Role of Water Phase in Molecular Biology: Importance of Water in Folding, Binding & Transport Phenomena Oral Invited
            The function of cell is governed by various interactions and co-existence of proteins, RNAs, DNA and...
            Recent Advances in Kinase Drug Discovery: A Joint Venture Between Medicinal, Biological & Computational Chemists Oral Invited
            • MEDI
            Protein kinases are involved in a wide range of human diseases and are therefore important drug targ...
            Quantum Mechanics Oral Contributed
              Protein Degradation Computational Design Oral Invited
                Proteolysis-targeting chimera (ProTAC), as a new therapeutic modality, is an emerging strategy in dr...
                OpenEye Outstanding Junior Faculty Award Poster Contributed
                  NVIDIA GPU Award Poster Contributed
                    Molecular Mechanics: Molecular Simulations for Materials Design Oral Contributed
                      Empirical interatomic potential has been widely used in materials design and studies. This symposium...
                      Molecular Mechanics: Conformational Dynamics of Receptors, Ion Channels & Transporters Oral Contributed
                        With the arrival of exciting new experimental techniques and computing hardware, molecular dynamics ...
                        Molecular Mechanics Oral Contributed
                          Material Science Oral Contributed
                            Immersive Virtual Reality for Molecular Design Oral Invited
                              Molecular visualization at the atomic level has been possible by the use of computers for over half ...
                              Exploring Transition Metal Chemistry & Spectroscopy with Quantum Chemistry Oral Contributed
                                Functional transition metal compounds, including molecules, clusters, nanoparticles, surfaces, and s...
                                Drug Design Oral Contributed
                                  Computational Studies of Water Oral Contributed
                                    COMP Poster Session Poster Contributed
                                      Chemical Computing Group Graduate Student Travel Awards Poster Contributed
                                        Advances in Multiscale Modeling Oral Invited
                                          The proposed symposium with the topic of “advances in multiscale modeling” aims to disseminate and...
                                          Advances in Multiscale Computational Modeling of Biomass Conversion Processes Oral Invited
                                            The ChemCatBio enabling project Consortium for Computational Physics and Chemistry (CCPC-CCB) accele...