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Application

Discovery Studio 1.0 Materials Studio 0.8924772036474165 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.053951367781155016 Amorphous Cell 0.27710233029381964 Blends 0.0017730496453900709 CASTEP 0.3171225937183384 CDOCKER 0.18363728470111448 CHARMm 0.28495440729483285 COMPASS 0.33080040526849036 COMPASS III 0.10714285714285714 COSMObase 0.004305977710233029 COSMOconf 0.005572441742654508 COSMOmic 0.0 COSMOperm 2.5329280648429586E-4 COSMOplex 2.5329280648429586E-4 COSMOquick 0.0010131712259371835 COSMOtherm 0.06306990881458967 Catalyst 0.09549138804457953 Classical Simulations 1.0 Conformers 5.065856129685917E-4 Crystallization 0.07092198581560284 DFTB Plus 0.005065856129685917 DMol3 0.14437689969604864 DPD 0.0025329280648429585 Discover 0.003292806484295846 Forcite 0.5146909827760892 GULP 0.01773049645390071 Kinetix 2.5329280648429586E-4 LUDI 0.0025329280648429585 LibDock 0.0726950354609929 LigandFit 0.0048125633232016215 MODELER 0.26646403242147926 MesoDyn 0.0 Mesocite 0.00303951367781155 Mesoscale 0.005319148936170213 Modules 0.0 Morphology 0.016717325227963525 ONETEP 0.0012664640324214793 Polymorph 0.0025329280648429585 QMERA 0.0 QSAR 2.5329280648429586E-4 Quantum Mechanics 0.45390070921985815 Reflex 0.050405268490374876 Reflex Plus 0.0010131712259371835 Semi-empirical 0.0060790273556231 Sorption 0.06003039513677812 Synthia 0.0012664640324214793 TURBOMOLE 2.5329280648429586E-4 VAMP 5.065856129685917E-4 Visualization 0.7763424518743668 X-Cell 7.598784194528875E-4 ZDOCK 0.030141843971631204

Year

2023 0.019375470278404815 2024 0.4159142212189616 2025 1.0 2026 0.5769375470278405 2027 0.0

Keywords

target 1.0 potential 0.31108490566037733 docking 0.2366745283018868 analysis 0.21580188679245282 visualization 0.18419811320754717 between 0.13643867924528302 novel 0.09375 promising 0.07959905660377359 binding 0.07476415094339622 energy 0.06804245283018868 activity 0.05660377358490566 cell 0.056485849056603775 stability 0.032900943396226415 performance 0.02688679245283019 including 0.020754716981132074 synthesized 0.018632075471698113 development 0.015919811320754717 mechanism 0.012617924528301887 effective 0.01214622641509434 interaction 0.00955188679245283 experimental 0.0071933962264150945 protein 0.006367924528301887 enhanced 8.254716981132076E-4 strong 7.075471698113207E-4 synthesis 0.0
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