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Application

Discovery Studio 1.0 Materials Studio 0.9886756841774142 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06800199586570675 Amorphous Cell 0.2757145912039347 Blends 0.0029225176420272295 CASTEP 0.4176348991375009 CDOCKER 0.1777746097369734 CHARMm 0.25768051892508376 COMPASS 0.37636324755862854 COMPASS III 0.07142347993442155 COSMObase 0.002779955805830779 COSMOconf 0.0031363603963219045 COSMOmic 2.138427542946753E-4 COSMOperm 0.0012117756076698268 COSMOplex 3.564045904911255E-4 COSMOquick 0.0016394611162591775 COSMOtherm 0.06379642169791147 Cantera 7.128091809822511E-5 Catalyst 0.11932425689642882 Classical Simulations 1.0 Conformers 0.001354337443866277 Crystallization 0.07612802052890441 DFTB Plus 0.005845035284054459 DMol3 0.19245847886520778 DPD 0.00320764131442013 Discover 0.005132226103072207 Forcite 0.5330387055385274 GULP 0.02765699622211134 Kinetix 2.138427542946753E-4 LUDI 0.006058878038349134 LibDock 0.07128091809822511 LigandFit 0.008553710171787013 MCSS 0.0015681801981609522 MODELER 0.1931000071280918 MesoDyn 0.0015681801981609522 Mesocite 0.004490697840188181 Mesoscale 0.008054743745099437 Modules 0.0 Morphology 0.01774894860645805 ONETEP 0.0012830565257680518 Polymorph 0.001924584788652078 QMERA 2.138427542946753E-4 QSAR 0.001425618361964502 Quantum Mechanics 0.59719153182693 Reflex 0.05616936346140138 Reflex Plus 7.12809180982251E-4 Semi-empirical 0.007912181908902987 Sorption 0.053531969491767056 Synthia 0.001425618361964502 TURBOMOLE 4.989664266875758E-4 VAMP 0.0017107420343574025 Visualization 0.8811034286121605 X-Cell 0.0011404946895716018 ZDOCK 0.03072207570033502

Year

2020 0.061955141768937794 2021 0.23910283537875582 2022 0.29310198899703765 2023 0.5157003808717732 2024 1.0 2025 0.9680067710537452 2026 0.35979686838764285 2027 0.0

Keywords

target 1.0 potential 0.25352869207126016 docking 0.20990122646295245 visualization 0.20984154456745546 analysis 0.17194354092685984 between 0.151084718450658 novel 0.09838560472680612 energy 0.08155531019665184 binding 0.0664557906359106 cell 0.05639939124466593 activity 0.05028199695622333 promising 0.040255438512727164 interaction 0.03927068723702665 experimental 0.027692399510608458 synthesized 0.026916534869147444 stability 0.022888006923099877 protein 0.018471546656321804 mechanism 0.016293157470681267 effective 0.014860791978753245 development 0.014502700605771239 performance 0.011846856256154696 synthesis 0.011250037301184686 including 0.004505983110023574 chemical 0.002805049088359046 design 0.0
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