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Application

Discovery Studio 0.9941091260260744 Materials Studio 1.0 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06462374891881874 Amorphous Cell 0.28061287532435436 Blends 0.0022241443222537995 CASTEP 0.3683430124799209 CDOCKER 0.16421598912640553 CHARMm 0.26108983071790437 COMPASS 0.35252687507722724 COMPASS III 0.09118991721240578 COSMObase 0.003830470777214877 COSMOconf 0.004818979364883232 COSMOmic 1.235635734585444E-4 COSMOperm 0.0012356357345854442 COSMOplex 1.235635734585444E-4 COSMOquick 0.001482762881502533 COSMOtherm 0.06388236747806747 Cantera 0.0 Catalyst 0.10799456320276782 Classical Simulations 1.0 Conformers 6.178178672927221E-4 Crystallization 0.07154330903249723 DFTB Plus 0.0051896700852588655 DMol3 0.16619300630174225 DPD 0.0027183986160879774 Discover 0.0037069072037563327 Forcite 0.5360187816631657 GULP 0.02125293463486964 Kinetix 1.235635734585444E-4 LUDI 0.0037069072037563327 LibDock 0.0698134190040776 LigandFit 0.004077597924131966 MCSS 4.942542938341777E-4 MODELER 0.2172247621401211 MesoDyn 8.64945014209811E-4 Mesocite 0.003212652909922155 Mesoscale 0.006301742246385766 Modules 0.0 Morphology 0.017051773137279132 ONETEP 0.0012356357345854442 Polymorph 0.0018534536018781664 QMERA 1.235635734585444E-4 QSAR 9.885085876683553E-4 Quantum Mechanics 0.5240331150376869 Reflex 0.051896700852588656 Reflex Plus 0.0011120721611268998 Semi-empirical 0.006795996540219943 Sorption 0.05708637093784752 Synthia 0.0012356357345854442 TURBOMOLE 4.942542938341777E-4 VAMP 0.0012356357345854442 Visualization 0.7895712344000988 X-Cell 0.001482762881502533 ZDOCK 0.02743111330779686

Year

2022 0.0 2023 0.2177258478198917 2024 0.49178303410278335 2025 1.0 2026 0.40467369620974636 2027 9.499382540134892E-4

Keywords

target 1.0 potential 0.29227174094475045 docking 0.22138763701107217 analysis 0.20102375785901075 visualization 0.19201023757859012 between 0.1519501474433873 novel 0.09992766928170033 energy 0.08395927224169587 binding 0.07088410393367829 promising 0.0676570411172314 cell 0.06309464196294441 activity 0.05218939520391699 stability 0.03850219774105603 performance 0.03149168196739554 interaction 0.028264619150948644 synthesized 0.02676236577087854 experimental 0.024314249151505034 including 0.019584932954988036 effective 0.018472152673454627 mechanism 0.018082679574917934 development 0.017581928448227896 protein 0.01290825126578757 synthesis 0.008067657041117232 design 2.2255605630668225E-4 enhanced 0.0
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