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COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
BioMed Central
2008
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4235602/ http://dx.doi.org/10.1186/1752-153X-2-S1-P15 |
| _version_ | 1782345053699571712 |
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| author | Thormann, M Klamt, A Wichmann, K Wittekindt, C Almstetter, M |
| author_facet | Thormann, M Klamt, A Wichmann, K Wittekindt, C Almstetter, M |
| author_sort | Thormann, M |
| collection | PubMed |
| description | |
| format | Online Article Text |
| id | pubmed-4235602 |
| institution | National Center for Biotechnology Information |
| language | English |
| publishDate | 2008 |
| publisher | BioMed Central |
| record_format | MEDLINE/PubMed |
| spelling | pubmed-42356022014-11-19 COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed Thormann, M Klamt, A Wichmann, K Wittekindt, C Almstetter, M Chem Cent J Poster Presentation BioMed Central 2008-03-26 /pmc/articles/PMC4235602/ http://dx.doi.org/10.1186/1752-153X-2-S1-P15 Text en Copyright © 2008 Thormann et al. |
| spellingShingle | Poster Presentation Thormann, M Klamt, A Wichmann, K Wittekindt, C Almstetter, M COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title | COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title_full | COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title_fullStr | COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title_full_unstemmed | COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title_short | COSMOsim and COSMOfrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| title_sort | cosmosim and cosmofrag: ab initio computation of bioisosterism and molecular properties with quantum-chemical accuracy at fingerprint speed |
| topic | Poster Presentation |
| url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4235602/ http://dx.doi.org/10.1186/1752-153X-2-S1-P15 |
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