SuAVE-Scatter: A Module for Integrating Simulations and SAXS/SANS Analyses
values. These methods expand SuAVE analytical capabilities, enabling efficient scattering calculations for systems with diverse geometries and structural resolutions. The SuAVE_Scatter package is publicly available at https://github.com/SuAVE-Software and https://www.biomatsite.net.
Authors
- Daniel L. Z. Caetano (ORCID: https://orcid.org/0000-0002-0476-3115)
- Thereza A. Soares (ORCID: https://orcid.org/0000-0002-5891-6906)
- Denys E. S. Santos (ORCID: https://orcid.org/0000-0002-1062-3602)
- Diane Lima (ORCID: https://orcid.org/0000-0003-0808-8644)
- Anderson A. do Espirito Santo
Institutions
- Universidade Federal de Pernambuco (BR)
- Facultad de Teología Pontificia y Civil de Lima (PE)
- Universidade Estadual Paulista (Unesp) (BR)
Publication Details
- Journal
- Journal of Chemical Information and Modeling
- Published
- 2026-04-23
- DOI
- https://doi.org/10.1021/acs.jcim.6c00402
- Primary Topic
- Enzyme Structure and Function
- Type
- article
- Field-Weighted Citation Impact
- 0.00
Funders
- Fundação de Amparo à Pesquisa do Estado de São Paulo
- Conselho Nacional de Desenvolvimento Científico e Tecnológico