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Application

Discovery Studio 1.0 Materials Studio 0.9744435917114351 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06561894070823554 Amorphous Cell 0.2759465251556281 Blends 0.002347178283498316 CASTEP 0.3834064700479641 CDOCKER 0.16858863149300948 CHARMm 0.2638024288192673 COMPASS 0.35677109909174404 COMPASS III 0.0839881620573528 COSMObase 0.0035717930401061334 COSMOconf 0.00428615164812736 COSMOmic 1.020512297173181E-4 COSMOperm 0.0013266659863251352 COSMOplex 2.041024594346362E-4 COSMOquick 0.0014287172160424534 COSMOtherm 0.06276150627615062 Cantera 0.0 Catalyst 0.12654352484947443 Classical Simulations 1.0 Conformers 7.143586080212267E-4 Crystallization 0.07327278293703439 DFTB Plus 0.005510766404735177 DMol3 0.1714460659250944 DPD 0.002347178283498316 Discover 0.003265639350954179 Forcite 0.5303602408409022 GULP 0.02357383406470048 Kinetix 2.041024594346362E-4 LUDI 0.004388202877844678 LibDock 0.0716399632615573 LigandFit 0.005510766404735177 MCSS 6.123073783039086E-4 MODELER 0.19155015817940607 MesoDyn 9.184610674558628E-4 Mesocite 0.003367690580671497 Mesoscale 0.006225125012756403 Modules 0.0 Morphology 0.01765486274109603 ONETEP 0.001020512297173181 Polymorph 0.0019389733646290438 QMERA 1.020512297173181E-4 QSAR 0.001020512297173181 Quantum Mechanics 0.5437289519338708 Reflex 0.05306663945300541 Reflex Plus 9.184610674558628E-4 Semi-empirical 0.007449739769364221 Sorption 0.05612817634452495 Synthia 0.0014287172160424534 TURBOMOLE 5.102561485865905E-4 VAMP 0.0016328196754770896 Visualization 0.8489641800183693 X-Cell 0.0013266659863251352 ZDOCK 0.02939075415858761

Year

2022 0.08005284015852047 2023 0.3621312197269925 2024 0.6125055041831792 2025 1.0 2026 0.37437252311756936 2027 0.0

Keywords

target 1.0 potential 0.2859552556818182 docking 0.2290926846590909 visualization 0.21173650568181818 analysis 0.19606711647727273 between 0.15349786931818182 novel 0.10431463068181818 energy 0.08553799715909091 binding 0.07652698863636363 cell 0.06298828125 promising 0.0615234375 activity 0.057173295454545456 stability 0.038884943181818184 interaction 0.03719815340909091 synthesized 0.03209339488636364 experimental 0.029163707386363636 performance 0.028231534090909092 protein 0.023792613636363636 development 0.022327769886363636 effective 0.021129261363636364 mechanism 0.020951704545454544 including 0.018687855113636364 synthesis 0.015181107954545454 design 0.0037730823863636365 chemical 0.0
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