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Application

Discovery Studio 0.9967995848110025 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06541328290132384 Amorphous Cell 0.2812326176437869 Blends 0.002224941595283124 CASTEP 0.3692290577372344 CDOCKER 0.16620313716764934 CHARMm 0.25987317832906887 COMPASS 0.35843809100011126 COMPASS III 0.08610523973745689 COSMObase 0.003448659472688842 COSMOconf 0.004338636110802091 COSMOmic 1.1124707976415619E-4 COSMOperm 0.001223717877405718 COSMOplex 1.1124707976415619E-4 COSMOquick 0.0013349649571698743 COSMOtherm 0.06218711758816331 Cantera 0.0 Catalyst 0.11514072755590166 Classical Simulations 1.0 Conformers 7.787295583490933E-4 Crystallization 0.0738680609633997 DFTB Plus 0.005006118589387028 DMol3 0.16820558460340415 DPD 0.0026699299143397486 Discover 0.003559906552452998 Forcite 0.5381021248192235 GULP 0.022026921793302925 Kinetix 2.2249415952831238E-4 LUDI 0.00467237735009456 LibDock 0.06975191901212593 LigandFit 0.005339859828679497 MCSS 7.787295583490933E-4 MODELER 0.20191344977194348 MesoDyn 0.0010012237178774056 Mesocite 0.0033374123929246855 Mesoscale 0.006452330626321059 Modules 0.0 Morphology 0.017910779842029146 ONETEP 0.0010012237178774056 Polymorph 0.0016687061964623428 QMERA 2.2249415952831238E-4 QSAR 8.899766381132495E-4 Quantum Mechanics 0.5275336522416286 Reflex 0.053621092446323286 Reflex Plus 0.0010012237178774056 Semi-empirical 0.006786071865613527 Sorption 0.056402269440427186 Synthia 0.001223717877405718 TURBOMOLE 5.56235398820781E-4 VAMP 0.0013349649571698743 Visualization 0.8030926688174436 X-Cell 0.0013349649571698743 ZDOCK 0.028479252419623985

Year

2022 0.06579570197860456 2023 0.2722711350941967 2024 0.6040897472309004 2025 1.0 2026 0.40244248792956544 2027 0.0

Keywords

target 1.0 potential 0.2867788580170755 docking 0.2223264077382421 visualization 0.2002171445491783 analysis 0.1999703893796575 between 0.1542219809505009 novel 0.10368652223264077 energy 0.08784484034940532 binding 0.07565513497507773 cell 0.06721610817746632 promising 0.0652420668212999 activity 0.05596407244731777 stability 0.04022109263189064 interaction 0.036273009919557814 performance 0.03281843754626659 synthesized 0.031189853427429304 experimental 0.02877165276612545 effective 0.0237378473079011 mechanism 0.023392390070571978 development 0.021368997680501406 including 0.021171593544884765 protein 0.019691062527759956 synthesis 0.013374130188027439 design 0.0044909440852785865 chemical 0.0
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