From owner-chemistry@ccl.net Tue Jul 2 04:52:01 2024 From: "Gerard van Westen gerard::lacdr.leidenuniv.nl" To: CCL Subject: CCL: Call for Papers - 13th ICCS Noordwijkerhout - June 1st to 5th 2025 Message-Id: <-55188-240701101543-20348-3fzysTmoW2O0YesKpHzDpQ[#]server.ccl.net> X-Original-From: "Gerard van Westen" Date: Mon, 1 Jul 2024 10:15:40 -0400 Sent to CCL by: "Gerard van Westen" [gerard[A]lacdr.leidenuniv.nl] C A L L F O R P A P E R S 13th International Conference on Chemical Structures NH Leeuwenhorst Conference Hotel, Noordwijkerhout, The Netherlands 1-5 June 2025 Visit the conference website at https://www.iccs-nl.org for more information. The 13th International Conference on Chemical Structures (ICCS) will be organized in June 2025. Building on past successes of the conference series, the 2025 event will offer a strong scientific program covering all aspects of cheminformatics and molecular modeling. We encourage the submission of papers both on method and algorithm development as well as applications and case studies. Highest standards of scientific quality and validation of results will be required. For this event the ICCS is seeking presentations of novel research and emerging technologies for the following plenary sessions: Advanced Cheminformatics Techniques Molecular Similarity and Diversity Analysis Chemical Literature and Patent Mining Spectroscopy and Structure Elucidation (Automated) Reaction Handling and Optimization Artificial Intelligence, Machine Learning, and QSAR Consensus, Federated Learning, and Uncertainty Quantification Advances in Large Language Models for Chemistry Synthetic Accessibility and Retrosynthesis Planning Multi-objective and Many-objective Optimization in Drug Design Integrative Structure-Based Drug Design Molecular Dynamics and Free Energy Calculations Structure-based and Rational Drug Design Innovations Modeling Complex Protein Interactions Computer-Assisted Protein Design and Engineering New Modalities and Large Chemical Data Sets Design, Profiling, and Comparison of Compound Collections Advances in DNA Encoded Libraries Covalent inhibitors and PROTACS Biologics and oligonucleotides Open Science, Omics, and Natural Products Open Access Publishing and Collaborative Platforms Findable, Accessible, Interoperable, and Reusable (FAIR) Advances in X-omics Natural Product Drug Discovery We also welcome contributions in other aspects of the computer handling of chemical structure information, such as: automatic structure elucidation combinatorial chemistry and diversity analysis, electronic publishing MM or QM/MM simulations modeling of ADME properties material sciences analysis and prediction of structures, grid and cloud computing in cheminformatics > From the submissions the program committee and the scientific advisory board will select around 30 papers for the plenary sessions. All submissions that cannot be included in the plenary sessions will be automatically considered for the poster sessions. Visit the conference website at https://www.iccs-nl.org for more information. Abstract submission will open at the end of July 2024. The deadline for the submission of abstracts is the 14th of February 2025. We hope to see you in Noordwijkerhout! On behalf of the organizing committee, Gerard van Westen