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Application

Discovery Studio 1.0 Materials Studio 0.9807000327118089 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06420112196135466 Amorphous Cell 0.27675046748389776 Blends 0.002077706212341575 CASTEP 0.3517556617494286 CDOCKER 0.16600872636609185 CHARMm 0.2723872844379805 COMPASS 0.34531477249116976 COMPASS III 0.08975690837315603 COSMObase 0.0035321005609806775 COSMOconf 0.005609806773322252 COSMOmic 0.0 COSMOperm 8.310824849366299E-4 COSMOplex 2.0777062123415748E-4 COSMOquick 0.0014543943486391025 COSMOtherm 0.06150010388531062 Cantera 0.0 Catalyst 0.10533970496571785 Classical Simulations 1.0 Conformers 8.310824849366299E-4 Crystallization 0.07230417618948681 DFTB Plus 0.0035321005609806775 DMol3 0.15749013089549138 DPD 0.0016621649698732599 Discover 0.003947641803448992 Forcite 0.5296073135258674 GULP 0.018491585289840018 Kinetix 0.0 LUDI 0.004363183045917307 LibDock 0.0708497818408477 LigandFit 0.00415541242468315 MCSS 8.310824849366299E-4 MODELER 0.22563889466029505 MesoDyn 8.310824849366299E-4 Mesocite 0.003739871182214835 Mesoscale 0.00581757739455641 Morphology 0.01641387907749844 ONETEP 0.0010388531061707874 Polymorph 0.0014543943486391025 QMERA 0.0 QSAR 8.310824849366299E-4 Quantum Mechanics 0.4994805734469146 Reflex 0.05339704965717847 Reflex Plus 4.1554124246831497E-4 Semi-empirical 0.00498649490961978 Sorption 0.05298150841471016 Synthia 6.233118637024725E-4 TURBOMOLE 4.1554124246831497E-4 VAMP 0.0010388531061707874 Visualization 0.766465821732807 X-Cell 0.0018699355911074174 ZDOCK 0.028672345730313735

Year

2023 0.16851475870685617 2024 0.38341402467593316 2025 1.0 2026 0.4785256910823052 2027 0.0

Keywords

target 1.0 potential 0.299163381094336 docking 0.22569477834407153 analysis 0.20376959323011828 visualization 0.18453697470910665 between 0.14597557457447832 novel 0.09991345321665544 binding 0.07279546110202904 energy 0.07260313491681893 promising 0.07010289450908741 cell 0.058370997211270315 activity 0.04740840465429368 stability 0.03923454178286374 performance 0.027406481392441583 including 0.02221367439176844 synthesized 0.018847966150591405 interaction 0.01846331378017117 development 0.01528993172420425 experimental 0.015193768631599193 effective 0.013655159149918262 mechanism 0.013270506779498028 protein 0.011539571112606981 synthesis 0.002307914222521396 strong 1.9232618521011636E-4 design 0.0
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