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Application

Discovery Studio 1.0 Materials Studio 0.4747934581015006 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.0630228667038483 Amorphous Cell 0.14500836586726157 Blends 8.365867261572784E-4 CASTEP 0.3006134969325153 CDOCKER 0.1731734523145566 CHARMm 0.3067484662576687 COMPASS 0.19827105409927495 COMPASS III 0.03680981595092025 COSMObase 0.0016731734523145567 COSMOconf 0.0019520356943669827 COSMOmic 0.0 COSMOperm 5.577244841048522E-4 COSMOplex 0.0 COSMOquick 2.788622420524261E-4 COSMOtherm 0.04182933630786392 Catalyst 0.12297824874511991 Classical Simulations 0.699665365309537 Conformers 5.577244841048522E-4 Crystallization 0.027049637479085332 DFTB Plus 0.004740658114891244 DMol3 0.11266034578918015 DPD 8.365867261572784E-4 Discover 0.0011154489682097045 Forcite 0.27328499721137756 GULP 0.015337423312883436 Kinetix 0.0 LUDI 0.004740658114891244 LibDock 0.08337981037367541 LigandFit 0.003067484662576687 MCSS 0.0 MODELER 0.24428332403792527 MesoDyn 2.788622420524261E-4 Mesocite 0.0013943112102621305 Mesoscale 0.0025097601784718347 Modules 0.0 Morphology 0.006971556051310652 Polymorph 5.577244841048522E-4 QMERA 2.788622420524261E-4 QSAR 0.0013943112102621305 Quantum Mechanics 0.40435025097601784 Reflex 0.01784718349135527 Reflex Plus 2.788622420524261E-4 Semi-empirical 0.006413831567205801 Sorption 0.023703290574456217 Synthia 2.788622420524261E-4 VAMP 8.365867261572784E-4 Visualization 1.0 X-Cell 0.0011154489682097045 ZDOCK 0.02872281093139989

Year

2021 0.04033832140533507 2022 0.2657774886141835 2023 0.4947950553025374 2024 0.907612231620039 2025 1.0 2026 0.28724788549121666 2027 0.0

Keywords

analysis 1.0 target 0.9413139444300181 docking 0.4034017138405609 potential 0.38444559854583227 visualization 0.27317579849389767 binding 0.14359906517787588 between 0.14074266424305376 novel 0.08517268242015061 protein 0.07712282524019735 interaction 0.06712542196831991 activity 0.06647623993767852 promising 0.04284601402233186 including 0.04167748636717736 stability 0.03985977668138146 silico 0.03583484809140483 energy 0.02947286419111919 drug 0.01350298623734095 compound 0.011425603739288496 mechanism 0.009088548428979486 experimental 0.006102311088029083 vitro 0.006102311088029083 therapeutic 0.004414437808361465 treatment 0.003895092183848351 cell 0.0012983640612827837 effective 0.0
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