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 July 6, 2020.

Title    Type    Submission Type Organizer Cosponsor Description
Advances in Multiscale Computational Modeling of Biomass Conversion Processes Oral Invited
    The ChemCatBio enabling project Consortium for Computational Physics and Chemistry (CCPC-CCB) accele...
    Advances in Multiscale Modeling Oral Invited
      The proposed symposium with the topic of “advances in multiscale modeling” aims to disseminate and...
      Computational Studies of Water Oral Contributed
        Drug Design Oral Contributed
          Exploring Transition Metal Chemistry & Spectroscopy with Quantum Chemistry Oral Contributed
            Functional transition metal compounds, including molecules, clusters, nanoparticles, surfaces, and s...
            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 ...
              Material Science Oral Contributed
                Molecular Mechanics Oral Contributed
                  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: Molecular Simulations for Materials Design Oral Contributed
                      Empirical interatomic potential has been widely used in materials design and studies. This symposium...
                      Protein Degradation Computational Design Oral Invited
                        Proteolysis-targeting chimera (ProTAC), as a new therapeutic modality, is an emerging strategy in dr...
                        Quantum Mechanics Oral Contributed
                          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...
                          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...
                            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...
                              Women Make COMP Oral Contributed
                                Women are under-represented in science, with a gender-gap particularly evident in the fundamental sc...
                                Chemical Computing Group Graduate Student Travel Awards Poster Contributed
                                  COMP Poster Session Poster Contributed
                                    NVIDIA GPU Award Poster Contributed
                                      OpenEye Outstanding Junior Faculty Award Poster Contributed
                                        Wiley Computers in Chemistry Outstanding Postdoc Award Poster Contributed
                                          Sci-Mix Poster Contributed