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Application

Discovery Studio 1.0 Materials Studio 0.9297750330833701 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06485380820599206 Amorphous Cell 0.27253038142221153 Blends 0.002406449284081338 CASTEP 0.3762483455661172 CDOCKER 0.176272410058958 CHARMm 0.2780652147755986 COMPASS 0.34737095415714114 COMPASS III 0.08639152929852004 COSMObase 0.0037299963903260737 COSMOconf 0.004812898568162676 COSMOmic 1.203224642040669E-4 COSMOperm 0.0014438695704488027 COSMOplex 2.406449284081338E-4 COSMOquick 0.0016845144988569367 COSMOtherm 0.06437251834917579 Cantera 0.0 Catalyst 0.12706052219949465 Classical Simulations 1.0 Conformers 7.219347852244014E-4 Crystallization 0.07147154373721573 DFTB Plus 0.0058958007459992785 DMol3 0.16592467813740824 DPD 0.002767416676693539 Discover 0.003128384069305739 Forcite 0.5221994946456503 GULP 0.022259655877752377 Kinetix 2.406449284081338E-4 LUDI 0.004451931175550475 LibDock 0.07496089519913368 LigandFit 0.005534833353387078 MCSS 6.016123210203345E-4 MODELER 0.20948141017928046 MesoDyn 9.625797136325352E-4 Mesocite 0.0028877391408976055 Mesoscale 0.006136445674407412 Modules 0.0 Morphology 0.017326434845385635 ONETEP 0.001203224642040669 Polymorph 0.0019251594272650704 QMERA 0.0 QSAR 0.0010829021778366022 Quantum Mechanics 0.5317049693177717 Reflex 0.051377692215136564 Reflex Plus 9.625797136325352E-4 Semi-empirical 0.007339670316448081 Sorption 0.05655155817591144 Synthia 0.0015641920346528696 TURBOMOLE 6.016123210203345E-4 VAMP 0.001203224642040669 Visualization 0.852604981350018 X-Cell 0.0014438695704488027 ZDOCK 0.029719648658404523

Year

2022 8.401792382374906E-4 2023 0.32701643017176996 2024 0.5386482449589246 2025 1.0 2026 0.3265496639283047 2027 0.0

Keywords

target 1.0 potential 0.2778457173604657 docking 0.22208090789023138 visualization 0.19772049112165532 analysis 0.1861761972313261 between 0.14405909113143864 novel 0.10243115002690407 binding 0.07767940126204569 energy 0.07606515677738102 promising 0.06344469989727534 cell 0.0580149684488578 activity 0.057036638458151934 stability 0.03443721567284645 interaction 0.03419263317516998 synthesized 0.03155114220026415 protein 0.024311500269040748 experimental 0.024262583769505453 performance 0.023186420779729003 development 0.02284400528298195 effective 0.02167000929413491 including 0.02010468130900553 mechanism 0.01878393582155261 synthesis 0.01712077483735264 design 0.003473071467005821 compound 0.0
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