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Application

Discovery Studio 0.9549485271633881 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06430910281597904 Amorphous Cell 0.2827766863130321 Blends 0.002226588081204977 CASTEP 0.36948264571054357 CDOCKER 0.16123117223313688 CHARMm 0.25802226588081206 COMPASS 0.35284872298624753 COMPASS III 0.09273084479371316 COSMObase 0.003929273084479371 COSMOconf 0.004715127701375246 COSMOmic 1.309757694826457E-4 COSMOperm 7.858546168958742E-4 COSMOplex 1.309757694826457E-4 COSMOquick 0.0015717092337917485 COSMOtherm 0.06470203012442698 Cantera 0.0 Catalyst 0.10124426981008514 Classical Simulations 1.0 Conformers 6.548788474132286E-4 Crystallization 0.07242960052390308 DFTB Plus 0.004846103470857891 DMol3 0.16542239685658153 DPD 0.0024885396201702686 Discover 0.00366732154551408 Forcite 0.5368696791093648 GULP 0.02082514734774067 Kinetix 1.309757694826457E-4 LUDI 0.00366732154551408 LibDock 0.06745252128356254 LigandFit 0.004060248853962017 MCSS 5.239030779305828E-4 MODELER 0.22278978388998036 MesoDyn 7.858546168958742E-4 Mesocite 0.0032743942370661427 Mesoscale 0.006024885396201702 Modules 0.0 Morphology 0.01715782580222659 ONETEP 0.0011787819253438114 Polymorph 0.0019646365422396855 QMERA 1.309757694826457E-4 QSAR 9.1683038637852E-4 Quantum Mechanics 0.5248199083169613 Reflex 0.052652259332023575 Reflex Plus 0.0010478061558611656 Semi-empirical 0.006548788474132285 Sorption 0.05697445972495088 Synthia 7.858546168958742E-4 TURBOMOLE 5.239030779305828E-4 VAMP 0.0013097576948264572 Visualization 0.7540275049115913 X-Cell 0.0015717092337917485 ZDOCK 0.026719056974459726

Year

2022 0.0 2023 0.153405090031184 2024 0.5024645407906649 2025 1.0 2026 0.42842772356905745 2027 0.0010059350165979278

Keywords

target 1.0 potential 0.29275031533425433 docking 0.214727611267944 analysis 0.20169379542314853 visualization 0.1804312571325605 between 0.15190101507598053 novel 0.09802390533966004 energy 0.08565078983722746 promising 0.06991410895549283 binding 0.0672713075860412 cell 0.0630067871944261 activity 0.04829118865997958 stability 0.040182593549162114 performance 0.03621839149498468 synthesized 0.02396540332752718 experimental 0.02378521232506457 interaction 0.022343684305363685 including 0.019700882935912066 effective 0.017658718241335816 mechanism 0.017478527238873207 development 0.016517508559072618 protein 0.00918974112559313 synthesis 0.005826175746291068 enhanced 0.003423629046789597 design 0.0
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