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Application

Discovery Studio 0.9185134674394818 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.07000696972043677 Amorphous Cell 0.28289320839464105 Blends 0.002710446836521335 CASTEP 0.4176411368388446 CDOCKER 0.1613103074421126 CHARMm 0.24223650584682102 COMPASS 0.3803144118330365 COMPASS III 0.07442112599705723 COSMObase 0.002942770851080307 COSMOconf 0.003329977542011926 COSMOmic 3.097653527452954E-4 COSMOperm 0.0013939440873538295 COSMOplex 4.6464802911794315E-4 COSMOquick 0.0014713854255401534 COSMOtherm 0.06481840006195307 Cantera 7.744133818632385E-5 Catalyst 0.11445829783938666 Classical Simulations 1.0 Conformers 0.0012390614109811817 Crystallization 0.07705413149539224 DFTB Plus 0.006117865716719585 DMol3 0.19383566948036862 DPD 0.0031750948656392784 Discover 0.004956245643924727 Forcite 0.5434833113916209 GULP 0.028033764423449237 Kinetix 2.3232401455897158E-4 LUDI 0.004956245643924727 LibDock 0.06675443351661117 LigandFit 0.0064276310694648805 MCSS 0.001161620072794858 MODELER 0.17664369240300473 MesoDyn 0.0018585921164717726 Mesocite 0.004181832262061489 Mesoscale 0.007976457833191357 Modules 0.0 Morphology 0.018198714473786105 ONETEP 0.001161620072794858 Polymorph 0.0020134747928444202 QMERA 4.6464802911794315E-4 QSAR 0.0013165027491675056 Quantum Mechanics 0.5986215441802835 Reflex 0.05676450089057539 Reflex Plus 7.744133818632386E-4 Semi-empirical 0.008595988538681949 Sorption 0.05668705955238906 Synthia 0.001626268101912801 TURBOMOLE 5.42089367304267E-4 VAMP 0.0018585921164717726 Visualization 0.8194842406876791 X-Cell 0.0012390614109811817 ZDOCK 0.02865329512893983

Year

2020 0.019961477849763615 2021 0.1297496060234635 2022 0.21073367186132025 2023 0.5066538259499213 2024 0.9356504990369462 2025 1.0 2026 0.3721765014883558 2027 0.0

Keywords

target 1.0 potential 0.25612978758989796 docking 0.1986285331995317 visualization 0.19622010369627027 analysis 0.17621675865529352 between 0.15514300050175614 novel 0.0944639571834755 energy 0.08911189162067236 binding 0.06168255561130624 cell 0.06047834085967553 activity 0.04455594581033618 promising 0.04455594581033618 interaction 0.03699615320287673 experimental 0.032112393376818864 stability 0.028399397892624186 synthesized 0.02595751797959525 performance 0.0231476835591236 mechanism 0.018732229469811006 effective 0.015621341361431678 development 0.014249874560963372 protein 0.01150694096002676 synthesis 0.008362602441879913 including 0.007961197524669677 chemical 0.002408429503261415 design 0.0
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