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Application

Discovery Studio 0.9980446017039899 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06935758953951109 Amorphous Cell 0.27395616196071 Antibody 1.8950161076369148E-4 Blends 0.0032846945865706526 CASTEP 0.4272629650685364 CDOCKER 0.18198471353673173 CHARMm 0.2580380266565599 COMPASS 0.37824521508432823 COMPASS III 0.06569389173141305 COSMObase 0.0024635209399279895 COSMOconf 0.002968858568631167 COSMOmic 2.5266881435158866E-4 COSMOperm 0.0012633440717579433 COSMOplex 5.053376287031773E-4 COSMOquick 0.001579180089697429 COSMOtherm 0.0648095508811825 Cantera 6.316720358789716E-5 Catalyst 0.1268397448044975 Classical Simulations 1.0 Conformers 0.0017055144968732233 Crystallization 0.07737982439517403 DFTB Plus 0.005937717137262334 DMol3 0.19967153054134293 DPD 0.003474196197334344 Discover 0.006443054765965511 Forcite 0.5292148316594024 GULP 0.028804244836081107 Kinetix 1.8950161076369148E-4 LUDI 0.006506221969553408 LibDock 0.07175794327585118 LigandFit 0.010043585370475649 MCSS 0.0018318489040490178 MODELER 0.2028298907207378 MesoDyn 0.0020213505148127093 Mesocite 0.0048007074726801845 Mesoscale 0.008780241298717706 Modules 0.0 Morphology 0.018444823447665973 ONETEP 0.0015160128861095318 Polymorph 0.001958183311224812 QMERA 3.7900322152738296E-4 QSAR 0.001579180089697429 Quantum Mechanics 0.6134167140420693 Reflex 0.05691365043269535 Reflex Plus 7.580064430547659E-4 Semi-empirical 0.008274903670014528 Sorption 0.05274461499589413 Synthia 0.0013896784789337376 TURBOMOLE 5.053376287031773E-4 VAMP 0.0018318489040490178 Visualization 0.8681700461120586 X-Cell 0.0011370096645821489 ZDOCK 0.031015096961657506

Year

2018 0.0023658639628221377 2019 0.08086185044359949 2020 0.16476552598225602 2021 0.26024503591043513 2022 0.3320659062103929 2023 0.7183776932826362 2024 1.0 2025 0.9663709336713139 2026 0.3591888466413181 2027 0.0

Keywords

target 1.0 potential 0.23898345215858569 visualization 0.20244139854252716 docking 0.2012049143668938 analysis 0.16242666596511537 between 0.15074583673147246 novel 0.09536713056746732 energy 0.07834574202204625 binding 0.06300807660940254 cell 0.05461576911946542 activity 0.05019599589592486 interaction 0.038225776748835864 promising 0.03480571413538186 experimental 0.02783404803872563 synthesized 0.025729394122753938 mechanism 0.017547552024413986 protein 0.01654784141432743 stability 0.015890137065586278 development 0.0109442003630528 effective 0.009944489752966247 synthesis 0.0088921627949804 performance 0.005971955486569677 chemical 0.003183289047907185 design 4.4723895714398465E-4 including 0.0
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