OPENEYE SCIENTIFIC SOFTWARE, INC

OpenEye Scientific Software, Inc. specializes in the development and delivery of advanced computational chemistry and drug discovery software platforms for scientific research. Their core capabilities encompass molecular modeling, structure-based drug design, and cheminformatics tools including OMEGA for conformer generation, ROCS for shape-based screening, FRED and HYBRID for molecular docking, SZMAP and SZYBKI for binding free energy analysis, and VIDA for 3D visualization. The company provides integrated software suites such as OEChem TK, QUACPAC, and SPRUCE that enable researchers to predict molecular properties, optimize lead compounds, and analyze protein-ligand interactions with high precision. Their solutions are engineered for reproducibility, scalability, and integration into high-throughput screening workflows, distinguishing them through rigorous algorithmic validation and domain-specific accuracy in virtual screening and pharmacophore modeling. OpenEye Scientific Software, Inc. has established a consistent relationship with the Department of Health and Human Services, delivering specialized software packages that support biomedical research, structural biology, and pharmaceutical development initiatives. Their engagements with HHS focus on equipping federal laboratories and research institutions with proprietary computational tools to accelerate drug discovery and enhance molecular insight without reliance on proprietary experimental data. The contractor operates under NAICS 513210 as a software publisher, focusing exclusively on scientific software for life sciences and pharmaceutical research. Their market positioning centers on providing validated, high-performance computational tools to government-funded researchers in chemistry, biology, and translational medicine. OpenEye Scientific Software, Inc. is a small business based in Santa Fe, New Mexico, with no federal certifications on record. The company maintains a focused, mission-driven presence in the federal scientific software market, serving specialized research communities through tailored software licensing and technical support.