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Application

Discovery Studio 1.0 Materials Studio 0.9684648631343045 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06637263339070568 Amorphous Cell 0.27527969018932874 Blends 0.0025817555938037868 CASTEP 0.38758605851979344 CDOCKER 0.17814113597246128 CHARMm 0.26861015490533563 COMPASS 0.35789586919104993 COMPASS III 0.0810025817555938 COSMObase 0.003227194492254733 COSMOconf 0.0039802065404475045 COSMOmic 2.151462994836489E-4 COSMOperm 8.605851979345956E-4 COSMOplex 2.151462994836489E-4 COSMOquick 0.0015060240963855422 COSMOtherm 0.06099397590361446 Cantera 0.0 Catalyst 0.11467297762478486 Classical Simulations 1.0 Conformers 0.0010757314974182443 Crystallization 0.07487091222030981 DFTB Plus 0.004625645438898451 DMol3 0.1765275387263339 DPD 0.002689328743545611 Discover 0.004302925989672977 Forcite 0.5277538726333907 GULP 0.02323580034423408 Kinetix 2.151462994836489E-4 LUDI 0.005593803786574871 LibDock 0.07164371772805508 LigandFit 0.006992254733218589 MCSS 0.0011833046471600688 MODELER 0.21105851979345955 MesoDyn 0.0011833046471600688 Mesocite 0.00387263339070568 Mesoscale 0.006992254733218589 Modules 0.0 Morphology 0.016673838209982788 ONETEP 0.0013984509466437177 Polymorph 0.0018287435456110154 QMERA 2.151462994836489E-4 QSAR 0.0010757314974182443 Quantum Mechanics 0.5532487091222031 Reflex 0.055615318416523236 Reflex Plus 6.454388984509467E-4 Semi-empirical 0.006561962134251291 Sorption 0.055507745266781414 Synthia 8.605851979345956E-4 TURBOMOLE 5.378657487091222E-4 VAMP 0.0015060240963855422 Visualization 0.8395008605851979 X-Cell 0.0012908777969018934 ZDOCK 0.030120481927710843

Year

2021 0.12248195626413874 2022 0.18442313907142088 2023 0.23516104707529895 2024 0.8324894969298718 2025 1.0 2026 0.4576106862005817 2027 0.0

Keywords

target 1.0 potential 0.27704055501233876 docking 0.22158588257205383 visualization 0.2040322205149695 analysis 0.19318340550356194 between 0.15169716440843695 novel 0.10178330306839875 energy 0.08120314755319644 binding 0.07445173906970247 cell 0.05955207896819854 promising 0.05666526982353215 activity 0.054663127997392556 interaction 0.035852307119243844 stability 0.03375704241746985 synthesized 0.02686594962052428 experimental 0.026027843739814687 performance 0.023839456162406295 mechanism 0.021185454206825906 effective 0.02090608557992271 protein 0.018717698002514317 development 0.016063696046933928 including 0.014666852912417936 synthesis 0.012478465335009545 design 0.0026540019555803883 chemical 0.0
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