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Application

Discovery Studio 1.0 Materials Studio 0.9772837119381343 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06090963734722501 Amorphous Cell 0.2787016629933881 Blends 0.002003606491685033 CASTEP 0.33099579242636745 CDOCKER 0.17130835503907033 CHARMm 0.2740933680625125 COMPASS 0.333600480865558 COMPASS III 0.10538970146263274 COSMObase 0.004808655580044079 COSMOconf 0.006010819475055099 COSMOmic 0.0 COSMOperm 4.007212983370066E-4 COSMOplex 2.003606491685033E-4 COSMOquick 0.0012021638950110197 COSMOtherm 0.06551793227810059 Catalyst 0.08194750550991785 Classical Simulations 1.0 Conformers 4.007212983370066E-4 Crystallization 0.07132839110398717 DFTB Plus 0.003205770386696053 DMol3 0.1506712081747145 DPD 0.0022039671408535366 Discover 0.004007212983370066 Forcite 0.519935884592266 GULP 0.019835704267681827 Kinetix 2.003606491685033E-4 LUDI 0.004007212983370066 LibDock 0.0727309156481667 LigandFit 0.004207573632538569 MCSS 4.007212983370066E-4 MODELER 0.2592666800240433 MesoDyn 6.010819475055099E-4 Mesocite 0.002805049088359046 Mesoscale 0.0054097375275495895 Modules 0.0 Morphology 0.01642957323181727 ONETEP 8.014425966740132E-4 Polymorph 0.0018032458425165298 QMERA 2.003606491685033E-4 QSAR 6.010819475055099E-4 Quantum Mechanics 0.4718493287918253 Reflex 0.05209376878381086 Reflex Plus 6.010819475055099E-4 Semi-empirical 0.004808655580044079 Sorption 0.055700260468843917 Synthia 0.0012021638950110197 TURBOMOLE 0.0 VAMP 0.0010018032458425166 Visualization 0.7160889601282309 X-Cell 0.0016028851933480265 ZDOCK 0.030454818673612504

Year

2023 0.0 2024 0.4786296900489396 2025 1.0 2026 0.6905383360522023 2027 0.0016313213703099511

Keywords

target 1.0 potential 0.3047218505065953 docking 0.2231886828522271 analysis 0.2159242974574651 visualization 0.16631619193270886 between 0.14624354807876122 novel 0.09510609826037086 promising 0.08325367998470656 energy 0.0739820302045498 binding 0.07359969413114127 cell 0.06012234754349073 activity 0.04865226534123494 stability 0.04004970368954311 performance 0.03527050277193653 including 0.021601988147581724 development 0.01567577900974957 synthesized 0.014719938826228254 effective 0.014528770789523991 mechanism 0.013286178550946283 experimental 0.01252150640412923 enhanced 0.008411393614987574 interaction 0.008315809596635443 strong 0.006499713247944944 protein 0.004779200917606577 design 0.0
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