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Application

Discovery Studio 0.8504067282503791 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.070139911634757 Amorphous Cell 0.29050073637702506 Blends 0.0023932253313696614 CASTEP 0.3873343151693667 CDOCKER 0.14469808541973492 CHARMm 0.23067010309278352 COMPASS 0.36818851251840945 COMPASS III 0.09075846833578792 COSMObase 0.0033136966126656848 COSMOconf 0.005891016200294551 COSMOmic 0.0 COSMOperm 0.0011045655375552283 COSMOplex 3.681885125184094E-4 COSMOquick 7.363770250368188E-4 COSMOtherm 0.06921944035346098 Cantera 0.0 Catalyst 0.101620029455081 Classical Simulations 1.0 Conformers 7.363770250368188E-4 Crystallization 0.0784241531664212 DFTB Plus 0.006075110456553756 DMol3 0.17065537555228277 DPD 0.002577319587628866 Discover 0.003865979381443299 Forcite 0.5578055964653903 GULP 0.019329896907216496 Kinetix 3.681885125184094E-4 LUDI 0.003681885125184094 LibDock 0.06130338733431517 LigandFit 0.0034977908689248897 MCSS 5.522827687776141E-4 MODELER 0.19035346097201766 MesoDyn 5.522827687776141E-4 Mesocite 0.0034977908689248897 Mesoscale 0.0062592047128129605 Morphology 0.01877761413843888 ONETEP 0.0014727540500736377 Polymorph 0.0016568483063328424 QMERA 0.0 QSAR 9.204712812960235E-4 Quantum Mechanics 0.5493372606774669 Reflex 0.05670103092783505 Reflex Plus 5.522827687776141E-4 Semi-empirical 0.008100147275405008 Sorption 0.058357879234167895 Synthia 0.0016568483063328424 TURBOMOLE 7.363770250368188E-4 VAMP 0.0016568483063328424 Visualization 0.7306701030927835 X-Cell 0.001288659793814433 ZDOCK 0.024300441826215022

Year

2022 0.0 2023 0.22343870470316113 2024 0.5474171164225135 2025 1.0 2026 0.4752505782575174 2027 0.001233616037008481

Keywords

target 1.0 potential 0.27898121509561685 docking 0.19707226265019462 analysis 0.19461837874428836 visualization 0.17591809104755457 between 0.15501776950414622 energy 0.09400913860213234 novel 0.09189372144186833 cell 0.06752411575562701 promising 0.06540869859536301 binding 0.06092401421560332 activity 0.04620071078016585 performance 0.04467761042477576 stability 0.039515992553731595 experimental 0.03173125740396006 synthesized 0.028600440006769336 interaction 0.024454222372651886 mechanism 0.021492638348282283 effective 0.02030800473853444 including 0.01971568793366052 development 0.017346420714164833 enhanced 0.006600101540023693 synthesis 0.006177018107970892 design 0.0035539008292435267 protein 0.0
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