Publications

26864 results for Science

Dataset of Reticular Materials' Syntheses Automatically Created from PDFs by using LLMs
- - Viviane T. Silva
  - Rodrigo Neumann Barros Ferreira
  - et al.
- 2024
- ACS Fall 2024
Talk
Selecting Covalent Organic Frameworks for Gas Capture using micro-Raman Spectroscopy
- - Geisa Lima
  - Matheus Esteves Ferreira
  - et al.
- 2024
- ACS Fall 2024
Talk
Lifecycle materials design tool
- - Brandi Ransom
  - Benjamin Wunsch
  - et al.
- 2024
- ACS Fall 2024
Talk
Atomistic simulations and machine learning approaches to investigate bromoform interactions with cell membranes: Implications for seaweed-based methane emission reduction
- - Jie Shi
  - Kevin Cheng
  - et al.
- 2024
- ACS Fall 2024
Talk
In-situ characterization of metal-organic frameworks: A combined DFT and micro-Raman spectroscopy approach
- - Matheus Esteves Ferreira
  - Geisa Lima
  - et al.
- 2024
- ACS Fall 2024
Talk
Towards accelerating small molecule drug discovery with pre-trained, late fusion multi-view models
- - Joseph Morrone
  - Diwakar Mahajan
  - et al.
- 2024
- ACS Fall 2024
Talk
Balancing Computational Chemistry's Green Potential With Its Environmental Impact
- - Oliver Schilter
  - Teodoro Laino
  - et al.
- 2024
- ACS Fall 2024
Talk
AI-Assisted Raman Spectral Peak Label Assignment
- - Ademir Ferreira Da Silva
  - Matheus Esteves Ferreira
  - et al.
- 2024
- ACS Fall 2024
Talk
MorganGen: Generative Modeling of SMILES Using Morgan Fingerprint Features
- - Lam Thanh Hoang
  - Raúl Fernández Díaz
  - et al.
- 2024
- ACS Fall 2024
Talk
A Multimodal Transformer Model for comprehensive Structure Elucidation
- - Marvin Alberts
  - Oliver Schilter
  - et al.
- 2024
- ACS Fall 2024
Talk