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Application

Discovery Studio 0.9315971834134347 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06867523260965884 Amorphous Cell 0.2860729582041057 Blends 0.0025107074287402157 CASTEP 0.39004578348840646 CDOCKER 0.16260522817899867 CHARMm 0.24531088465514694 COMPASS 0.3681878599911387 COMPASS III 0.08373947718210013 COSMObase 0.0031014621178555605 COSMOconf 0.004873726185201595 COSMOmic 1.476886722788362E-4 COSMOperm 0.001329198050509526 COSMOplex 4.4306601683650863E-4 COSMOquick 5.907546891153448E-4 COSMOtherm 0.0669029685423128 Cantera 0.0 Catalyst 0.11608329641116526 Classical Simulations 1.0 Conformers 7.38443361394181E-4 Crystallization 0.07576428887904298 DFTB Plus 0.006350612907989957 DMol3 0.17545414266725742 DPD 0.003249150790134397 Discover 0.0038399054792497417 Forcite 0.5460050214148575 GULP 0.021710234824988923 Kinetix 2.953773445576724E-4 LUDI 0.004135282823807414 LibDock 0.06542608181952445 LigandFit 0.005612169546595776 MCSS 4.4306601683650863E-4 MODELER 0.18018018018018017 MesoDyn 7.38443361394181E-4 Mesocite 0.0038399054792497417 Mesoscale 0.006941367597105302 Morphology 0.018018018018018018 ONETEP 0.001329198050509526 Polymorph 0.0017722640673460345 QMERA 2.953773445576724E-4 QSAR 8.861320336730173E-4 Quantum Mechanics 0.5564909171466549 Reflex 0.05508787476000591 Reflex Plus 4.4306601683650863E-4 Semi-empirical 0.008418254319893664 Sorption 0.056712450155073105 Synthia 0.001329198050509526 TURBOMOLE 5.907546891153448E-4 VAMP 0.001476886722788362 Visualization 0.7873283119184759 X-Cell 0.001476886722788362 ZDOCK 0.029390045783488406

Year

2022 0.14167969305101605 2023 0.30339633366491403 2024 0.6957510302685803 2025 1.0 2026 0.5054710814267444 2027 0.0

Keywords

target 1.0 potential 0.2747563866210166 docking 0.20799315248880695 analysis 0.1914011061364235 visualization 0.1906768501448512 between 0.1538714774822228 novel 0.09494337634974981 energy 0.08862259678693706 binding 0.06663155122465104 cell 0.06584145377929945 promising 0.05813800368712141 activity 0.05043455359494338 stability 0.03812220173821438 performance 0.03285488543587042 experimental 0.030287068738477745 synthesized 0.02962865420068475 interaction 0.028970239662891757 mechanism 0.02264946010007901 effective 0.01929154595733474 development 0.01685541216750066 including 0.01672372925994206 synthesis 0.010534632604687911 protein 0.0076376086383987355 design 0.0024361337898340797 chemical 0.0
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