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Application

Discovery Studio 1.0 Materials Studio 0.9779005524861878 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06779661016949153 Amorphous Cell 0.2730986527596697 Blends 0.002781399391568883 CASTEP 0.40243372446762277 CDOCKER 0.17470664928292046 CHARMm 0.2624076488483268 COMPASS 0.3682746631899174 COMPASS III 0.07735767057800956 COSMObase 0.0031290743155149934 COSMOconf 0.003737505432420687 COSMOmic 2.607561929595828E-4 COSMOperm 0.001303780964797914 COSMOplex 3.476749239461104E-4 COSMOquick 0.001738374619730552 COSMOtherm 0.06249456757931334 Cantera 0.0 Catalyst 0.12073011734028684 Classical Simulations 1.0 Conformers 9.561060408518036E-4 Crystallization 0.07561929595827901 DFTB Plus 0.005649717514124294 DMol3 0.18305084745762712 DPD 0.002781399391568883 Discover 0.004259017818339852 Forcite 0.5310734463276836 GULP 0.02494567579313342 Kinetix 2.607561929595828E-4 LUDI 0.005215123859191656 LibDock 0.0711864406779661 LigandFit 0.007388092133854845 MCSS 0.0011299435028248588 MODELER 0.19478487614080833 MesoDyn 0.001303780964797914 Mesocite 0.003737505432420687 Mesoscale 0.0070404172099087356 Modules 0.0 Morphology 0.017383746197305518 ONETEP 0.0013906996957844416 Polymorph 0.0018252933507170795 QMERA 1.738374619730552E-4 QSAR 0.001303780964797914 Quantum Mechanics 0.5735767057800956 Reflex 0.055888744024337245 Reflex Plus 7.822685788787483E-4 Semi-empirical 0.007388092133854845 Sorption 0.05536723163841808 Synthia 0.001303780964797914 TURBOMOLE 5.215123859191656E-4 VAMP 0.0013906996957844416 Visualization 0.8686657974793568 X-Cell 0.001303780964797914 ZDOCK 0.030421555845284658

Year

2020 0.020246478873239437 2021 0.1301056338028169 2022 0.1618838028169014 2023 0.415580985915493 2024 0.7972711267605633 2025 1.0 2026 0.3742077464788732 2027 0.0

Keywords

target 1.0 potential 0.2681328446073531 docking 0.21818653041578734 visualization 0.21089266540782703 analysis 0.18364248954052353 between 0.15180125143470696 novel 0.10092931985634418 energy 0.08293531785701062 binding 0.0720130326928061 cell 0.0583138953682106 activity 0.05294531452478803 promising 0.05061275871005961 interaction 0.0378392387722611 stability 0.029434632900144395 synthesized 0.027361249953719132 experimental 0.02628753378503462 protein 0.01914176755896183 mechanism 0.01877152060424303 performance 0.01869747121329927 effective 0.01854937243141175 development 0.0171794586989522 synthesis 0.01299566811062979 including 0.010515013514013847 design 0.0011847902551001517 chemical 0.0
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