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Application

Discovery Studio 0.8526785714285714 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.03832951945080092 Amorphous Cell 0.2837528604118993 Blends 0.0011441647597254005 CASTEP 0.35812356979405036 CDOCKER 0.16704805491990846 CHARMm 0.2808924485125858 COMPASS 0.35583524027459956 COMPASS III 0.07951945080091533 COSMObase 0.006864988558352402 COSMOconf 0.002860411899313501 COSMOperm 5.720823798627002E-4 COSMOplex 0.0011441647597254005 COSMOquick 0.002860411899313501 COSMOtherm 0.08524027459954234 Catalyst 0.21739130434782608 Classical Simulations 1.0 Conformers 5.720823798627002E-4 Crystallization 0.09782608695652174 DFTB Plus 0.006292906178489702 DMol3 0.2145308924485126 DPD 0.0017162471395881006 Discover 0.005148741418764302 Forcite 0.5200228832951945 GULP 0.02803203661327231 Kinetix 0.0 LUDI 0.011441647597254004 LibDock 0.07036613272311212 LigandFit 0.005720823798627002 MCSS 0.002288329519450801 MODELER 0.13443935926773457 MesoDyn 0.0017162471395881006 Mesocite 0.004004576659038902 Mesoscale 0.007437070938215103 Morphology 0.02688787185354691 ONETEP 0.0 Polymorph 5.720823798627002E-4 QMERA 0.0011441647597254005 QSAR 0.005148741418764302 Quantum Mechanics 0.5612128146453089 Reflex 0.06922196796338673 Reflex Plus 5.720823798627002E-4 Semi-empirical 0.009725400457665904 Sorption 0.05320366132723112 Synthia 0.003432494279176201 TURBOMOLE 0.0 VAMP 0.0011441647597254005 Visualization 0.6161327231121282 ZDOCK 0.02345537757437071

Year

2021 0.07650643195666892 2022 0.22951929587000677 2023 0.45429925524712256 2024 0.8788083953960731 2025 1.0 2026 0.4712254570074475 2027 0.0

Keywords

design 1.0 target 0.9424296221151408 potential 0.2226730915546538 novel 0.19553639360892722 synthesis 0.17093583565812834 docking 0.16205934567588132 between 0.13745878772508244 synthesized 0.11539436976921126 analysis 0.11209738777580522 visualization 0.1077859497844281 promising 0.09586609180826781 performance 0.08673598782652803 development 0.08648237382703525 energy 0.08622875982754248 cell 0.07177276185645448 activity 0.06720770986558458 designed 0.05934567588130865 compound 0.053766167892467666 binding 0.03880294192239411 stability 0.03702764392594471 effective 0.03144813593710373 strategy 0.023839715952320567 efficient 0.00887648998224702 experimental 0.007101191985797616 potent 0.0
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