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Application

Discovery Studio 1.0 Materials Studio 0.6084460844608446 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06391526661796933 Amorphous Cell 0.22169466764061357 Blends 0.002556610664718773 CASTEP 0.3133674214755296 CDOCKER 0.2176771365960555 CHARMm 0.3491599707815924 COMPASS 0.3385682980277575 COMPASS III 0.03761869978086194 COSMObase 7.304601899196494E-4 COSMOconf 3.652300949598247E-4 COSMOmic 0.0 COSMOperm 7.304601899196494E-4 COSMOquick 3.652300949598247E-4 COSMOtherm 0.04200146092037984 Catalyst 0.1468224981738495 Classical Simulations 0.964572680788897 Conformers 7.304601899196494E-4 Crystallization 0.07121986851716582 DFTB Plus 0.00620891161431702 DMol3 0.15303140978816654 DPD 0.003287070854638422 Discover 0.0018261504747991235 Forcite 0.4368151935719503 GULP 0.026296566837107377 Kinetix 0.0 LUDI 0.003652300949598247 LibDock 0.09276844411979547 LigandFit 0.006574141709276844 MCSS 0.001095690284879474 MODELER 0.3298027757487217 MesoDyn 0.002556610664718773 Mesocite 0.004017531044558071 Mesoscale 0.008400292184075968 Morphology 0.01643535427319211 ONETEP 3.652300949598247E-4 Polymorph 7.304601899196494E-4 QMERA 0.0 QSAR 7.304601899196494E-4 Quantum Mechanics 0.4587289992695398 Reflex 0.05368882395909423 Semi-empirical 0.008765522279035792 Sorption 0.03761869978086194 Synthia 0.0018261504747991235 TURBOMOLE 7.304601899196494E-4 VAMP 0.0018261504747991235 Visualization 1.0 X-Cell 0.0 ZDOCK 0.036523009495982466

Year

2024 0.0

Keywords

target 1.0 potential 0.31146816037735847 docking 0.29009433962264153 visualization 0.22435141509433962 analysis 0.20445165094339623 between 0.13045400943396226 novel 0.10244693396226415 binding 0.09596108490566038 activity 0.07075471698113207 protein 0.04584316037735849 interaction 0.03773584905660377 promising 0.03567216981132076 energy 0.0234375 cell 0.021816037735849055 synthesized 0.013561320754716982 synthesis 0.01061320754716981 stability 0.009581367924528301 effective 0.00869693396226415 development 0.006338443396226415 vitro 0.006338443396226415 silico 0.005454009433962264 including 0.004422169811320755 mechanism 0.0036851415094339623 compound 4.422169811320755E-4 drug 0.0
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