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Application

Discovery Studio 1.0 Materials Studio 0.967718965107999 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06759604473982818 Amorphous Cell 0.2767871616145242 Blends 0.00259361322742746 CASTEP 0.40273950397147024 CDOCKER 0.1766088507051386 CHARMm 0.26114443183660235 COMPASS 0.3691846328416275 COMPASS III 0.0758631869022532 COSMObase 0.0030799157075701088 COSMOconf 0.003566218187712757 COSMOmic 2.4315124007132436E-4 COSMOperm 0.001377857027070838 COSMOplex 3.242016534284325E-4 COSMOquick 0.0014589074404279462 COSMOtherm 0.06321932241854433 Cantera 0.0 Catalyst 0.12805965310423084 Classical Simulations 1.0 Conformers 9.726049602852974E-4 Crystallization 0.07553898524882477 DFTB Plus 0.005835629761711785 DMol3 0.18244448046685038 DPD 0.003160966120927217 Discover 0.004214621494569622 Forcite 0.5316096612092722 GULP 0.02553088020748906 Kinetix 2.4315124007132436E-4 LUDI 0.00518722645485492 LibDock 0.07164856540768358 LigandFit 0.006889285135354191 MCSS 0.0010536553736424056 MODELER 0.18641595072134867 MesoDyn 0.0016210082671421625 Mesocite 0.00429567190792673 Mesoscale 0.007942940508996596 Modules 0.0 Morphology 0.017506889285135354 ONETEP 9.726049602852974E-4 Polymorph 0.002026260333927703 QMERA 2.4315124007132436E-4 QSAR 0.0012157562003566218 Quantum Mechanics 0.573512724914897 Reflex 0.05560058356297617 Reflex Plus 7.294537202139731E-4 Semi-empirical 0.007861890095639487 Sorption 0.05446587777597666 Synthia 0.001377857027070838 TURBOMOLE 5.673528934997568E-4 VAMP 0.0016210082671421625 Visualization 0.8824769006321932 X-Cell 0.0012157562003566218 ZDOCK 0.03055600583562976

Year

2021 0.11355471830368878 2022 0.2971173223517042 2023 0.3790414439674056 2024 0.9489179006396214 2025 1.0 2026 0.37246999036186806 2027 0.0

Keywords

target 1.0 potential 0.2675964858305131 docking 0.2212764502786039 visualization 0.21406351485317746 analysis 0.18319488599459885 between 0.15184767374286398 novel 0.10135712576487882 energy 0.08241889720712406 binding 0.07257375311933818 cell 0.05937852527945852 activity 0.053874816258161554 promising 0.046866988001230646 interaction 0.040337743137455986 synthesized 0.03049259904967012 stability 0.03025330735309199 experimental 0.028715003589375447 protein 0.02098930024271015 mechanism 0.01863056780501145 effective 0.018391276108433323 performance 0.017741770074864115 development 0.01722900215362527 synthesis 0.014562608963183264 including 0.01145181690766759 design 0.0014357501794687725 chemical 0.0
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