Search results
- 1.0503194 - ÚMG 2019 RIV CZ eng M - Monography Chapter
Šícho, M. - Svozil, Daniel
Molecular docking in virtual drug design: overview and new challenges. Advances in Chemical Biology.
Advances in Chemical Biology. Praha: OPTIO CZ, 2019 - (Bartůněk, P.), s. 174-186. ISBN 978-80-88011-03-3
R&D Projects: GA MŠMT LO1220
Institutional support: RVO:68378050
Keywords : molecular docking * computer-aided drug design * structure-based drug design * virtual screening
OECD category: Computer sciences, information science, bioinformathics (hardware development to be 2.2, social aspect to be 5.8)
Permanent Link: http://hdl.handle.net/11104/0295019 - 2.0503192 - ÚMG 2019 RIV CZ eng M - Monography Chapter
Svozil, Daniel
Computational screening of biologically active compounds.
Advances in Chemical Biology. Praha: OPTIO CZ, 2019 - (Bartůněk, P.), s. 197-203. ISBN 978-80-88011-03-3
R&D Projects: GA MŠMT LO1220
Institutional support: RVO:68378050
Keywords : biologically active compounds * computational screening * 3D structure of target protein
OECD category: Computer sciences, information science, bioinformathics (hardware development to be 2.2, social aspect to be 5.8)
Permanent Link: http://hdl.handle.net/11104/0295018 - 3.0502892 - ÚMG 2019 RIV CZ eng M - Monography Chapter
Novotný, Jiří - Svozil, Daniel
Small Overview of Molecular Descriptors.
Advances in Chemical Biology. Praha: OPTIO CZ, 2019 - (Bartůněk, P.), s. 159-165. ISBN 978-80-88011-03-3
R&D Projects: GA MŠMT LO1220
Institutional support: RVO:68378050
Keywords : cheminformatics * structure * physico-chemical descriptors * theoretical descriptors
OECD category: Computer sciences, information science, bioinformathics (hardware development to be 2.2, social aspect to be 5.8)
Permanent Link: http://hdl.handle.net/11104/0295013 - 4.0502862 - ÚMG 2019 RIV CZ eng M - Monography Chapter
Čmelo, I. - Svozil, Daniel
The Concept of Chemical Space.
Advances in Chemical Biology. Praha: OPTIO CZ, 2019 - (Bartůněk, P.), s. 138-147. ISBN 978-80-88011-03-3
R&D Projects: GA MŠMT LO1220
Institutional support: RVO:68378050
Keywords : chemical space * structure * cheminformatics
OECD category: Computer sciences, information science, bioinformathics (hardware development to be 2.2, social aspect to be 5.8)
Permanent Link: http://hdl.handle.net/11104/0294980