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Application

Discovery Studio 1.0 Materials Studio 0.9674761491760624 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06834714938250719 Amorphous Cell 0.27423447809169343 Blends 0.002622229741160548 CASTEP 0.4010319742852309 CDOCKER 0.17661986127558787 CHARMm 0.26298426662155305 COMPASS 0.36550499069531384 COMPASS III 0.07697513111148706 COSMObase 0.0032143461343258333 COSMOconf 0.0036372864151581795 COSMOmic 2.5376416849940786E-4 COSMOperm 0.0012688208424970395 COSMOplex 2.5376416849940786E-4 COSMOquick 0.0015225850109964474 COSMOtherm 0.06234139739468787 Cantera 0.0 Catalyst 0.1261207917442057 Classical Simulations 1.0 Conformers 0.0010150566739976314 Crystallization 0.07536795804432414 DFTB Plus 0.005498223650820504 DMol3 0.18364066993740483 DPD 0.0027914058534934867 Discover 0.004144814752156996 Forcite 0.5309592285569278 GULP 0.025461004906107258 Kinetix 2.5376416849940786E-4 LUDI 0.004990695313821688 LibDock 0.0721536119099983 LigandFit 0.007020808661816952 MCSS 0.0010150566739976314 MODELER 0.18617831162239892 MesoDyn 0.0013534088986635088 Mesocite 0.004060226695990526 Mesoscale 0.007274572830316359 Modules 0.0 Morphology 0.017255963457959735 ONETEP 0.0012688208424970395 Polymorph 0.0018609372356623245 QMERA 1.691761123329386E-4 QSAR 0.0012688208424970395 Quantum Mechanics 0.5726611402469971 Reflex 0.05574352901370327 Reflex Plus 7.612925054982237E-4 Semi-empirical 0.007443748942649298 Sorption 0.055574352901370326 Synthia 0.001437996954829978 TURBOMOLE 5.075283369988157E-4 VAMP 0.0016071730671629167 Visualization 0.8806462527491118 X-Cell 0.0011842327863305702 ZDOCK 0.030959228556927763

Year

2021 0.099641012170563 2022 0.24656334821819456 2023 0.3771123369232116 2024 0.8789072760703966 2025 1.0 2026 0.37220908852114526 2027 0.0

Keywords

target 1.0 potential 0.270142350030478 docking 0.2207680447488257 visualization 0.21388361002545805 analysis 0.18483990103625086 between 0.15174441536089497 novel 0.10122270429201477 energy 0.08203951378679766 binding 0.07142601025493922 cell 0.05805156154756356 activity 0.0538563591380114 promising 0.04847789451038044 interaction 0.039226935350855176 stability 0.030119401914733408 synthesized 0.02900785255835634 experimental 0.02714331815411094 protein 0.0198644626913837 mechanism 0.018466061888199648 performance 0.018286779733945283 effective 0.018215066872243536 development 0.016458101760550754 synthesis 0.013553730861630033 including 0.011007924271218043 design 2.868514468069848E-4 chemical 0.0
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