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Application

Discovery Studio 0.9762480756542775 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06753059755219583 Amorphous Cell 0.28207343412527 Blends 0.0023038156947444203 CASTEP 0.3929445644348452 CDOCKER 0.17264218862491001 CHARMm 0.257451403887689 COMPASS 0.36688264938804893 COMPASS III 0.08149748020158387 COSMObase 0.0033117350611951042 COSMOconf 0.004895608351331893 COSMOmic 1.4398848092152627E-4 COSMOperm 0.0012958963282937365 COSMOplex 4.3196544276457883E-4 COSMOquick 0.0011519078473722101 COSMOtherm 0.06868250539956804 Cantera 0.0 Catalyst 0.1210943124550036 Classical Simulations 1.0 Conformers 7.199424046076314E-4 Crystallization 0.07688984881209503 DFTB Plus 0.0063354931605471565 DMol3 0.17782577393808496 DPD 0.003599712023038157 Discover 0.004175665946724262 Forcite 0.5392368610511159 GULP 0.021454283657307414 Kinetix 2.8797696184305253E-4 LUDI 0.005039596832253419 LibDock 0.06940244780417566 LigandFit 0.005759539236861051 MCSS 4.3196544276457883E-4 MODELER 0.18718502519798416 MesoDyn 0.0012958963282937365 Mesocite 0.0038876889848812094 Mesoscale 0.007631389488840893 Morphology 0.018862491000719944 ONETEP 0.0012958963282937365 Polymorph 0.0021598272138228943 QMERA 1.4398848092152627E-4 QSAR 0.0012958963282937365 Quantum Mechanics 0.561411087113031 Reflex 0.05485961123110151 Reflex Plus 5.759539236861051E-4 Semi-empirical 0.008207343412526998 Sorption 0.05572354211663067 Synthia 0.0012958963282937365 TURBOMOLE 5.759539236861051E-4 VAMP 0.0014398848092152627 Visualization 0.8061915046796256 X-Cell 0.0012958963282937365 ZDOCK 0.03023758099352052

Year

2022 0.17019532850703456 2023 0.28944133315120885 2024 0.7436142603469471 2025 1.0 2026 0.44611391886354324 2027 0.0

Keywords

target 1.0 potential 0.2600284832660812 docking 0.2010443864229765 visualization 0.18075005934013766 analysis 0.1778423925943508 between 0.14128886779017327 novel 0.09138381201044386 energy 0.07898172323759792 binding 0.06806313790647994 cell 0.06046760028483266 promising 0.05572038927130311 activity 0.051091858533111795 stability 0.03251839544267743 synthesized 0.02925468787087586 interaction 0.027177783052456682 experimental 0.025990980299074293 performance 0.02237123190125801 effective 0.019641585568478517 mechanism 0.017683361025397578 including 0.01649655827201519 development 0.016081177308331356 synthesis 0.012580109185853311 protein 0.010562544505103251 design 0.0018988844054118206 chemical 0.0
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