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Application

Discovery Studio 1.0 Materials Studio 0.544540886249429 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07344854673998429 Amorphous Cell 0.17124901806755696 Blends 0.001178318931657502 CASTEP 0.3644933228593873 CDOCKER 0.17949725058915947 CHARMm 0.33424980361351136 COMPASS 0.2258444619010212 COMPASS III 0.04556166535742341 COSMObase 0.002356637863315004 COSMOconf 0.0027494108405341712 COSMOmic 0.0 COSMOperm 7.855459544383347E-4 COSMOquick 3.9277297721916735E-4 COSMOtherm 0.05066771406127259 Catalyst 0.11861743912018853 Classical Simulations 0.795758051846033 Conformers 3.9277297721916735E-4 Crystallization 0.031421838177533384 DFTB Plus 0.005106048703849175 DMol3 0.13236449332285938 DPD 0.001178318931657502 Discover 0.001178318931657502 Forcite 0.3185388845247447 GULP 0.0192458758837392 Kinetix 0.0 LUDI 0.00589159465828751 LibDock 0.08994501178318931 LigandFit 0.0019638648860958365 MODELER 0.30243519245875883 MesoDyn 0.0 Mesocite 0.0019638648860958365 Mesoscale 0.003142183817753339 Modules 0.0 Morphology 0.008248232521602514 Polymorph 7.855459544383347E-4 QMERA 0.0 QSAR 0.0015710919088766694 Quantum Mechanics 0.48586017282010996 Reflex 0.0204241948153967 Reflex Plus 3.9277297721916735E-4 Semi-empirical 0.00589159465828751 Sorption 0.02788688138256088 Synthia 0.0 VAMP 0.0 Visualization 1.0 X-Cell 0.0015710919088766694 ZDOCK 0.029850746268656716

Year

2022 0.026776859504132233 2023 0.29024793388429754 2024 0.7586776859504132 2025 1.0 2026 0.291900826446281 2027 0.0

Keywords

analysis 1.0 target 0.9305463024650233 potential 0.3984010659560293 docking 0.37841439040639574 visualization 0.2350099933377748 between 0.1427381745502998 binding 0.13757495003331113 novel 0.07861425716189208 activity 0.06229180546302465 protein 0.060626249167221855 promising 0.05896069287141906 interaction 0.057461692205196535 stability 0.055629580279813455 including 0.05146568954030646 energy 0.04113924050632911 silico 0.02698201199200533 therapeutic 0.015156562291805464 mechanism 0.009327115256495669 experimental 0.00816122584943371 drug 0.006162558294470353 compound 0.004996668887408394 strong 0.002664890073284477 cell 0.001998667554963358 vitro 6.662225183211193E-4 treatment 0.0
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