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Application

Discovery Studio 1.0 Materials Studio 0.9609936055090998 Solvation Chemistry 0.0

Modules

Adsorption Locator 0.06749640976543801 Amorphous Cell 0.27381522259454283 Antibody 2.051562606852219E-4 Blends 0.0030773439102783286 CASTEP 0.4150995007864323 CDOCKER 0.183683238733502 CHARMm 0.26287355535799767 COMPASS 0.3749572591123572 COMPASS III 0.06954797237229023 COSMObase 0.002667031388907885 COSMOconf 0.0030773439102783286 COSMOmic 2.051562606852219E-4 COSMOperm 0.001162552143882924 COSMOplex 3.4192710114203654E-4 COSMOquick 0.001572864665253368 COSMOtherm 0.06387198249333242 Cantera 6.83854202284073E-5 Catalyst 0.11960609997948438 Classical Simulations 1.0 Conformers 0.0014360938247965534 Crystallization 0.07652328523558777 DFTB Plus 0.005949531559871436 DMol3 0.19257334336319495 DPD 0.003145729330506736 Discover 0.005470833618272585 Forcite 0.5284141421049032 GULP 0.027696095192504957 Kinetix 2.051562606852219E-4 LUDI 0.00608630240032825 LibDock 0.07269370170279696 LigandFit 0.009300417151063393 MCSS 0.001572864665253368 MODELER 0.1992751145455789 MesoDyn 0.0019147917663954045 Mesocite 0.004445052314846475 Mesoscale 0.008274635847637284 Modules 0.0 Morphology 0.01805375094029953 ONETEP 0.0012309375641113315 Polymorph 0.0019147917663954045 QMERA 3.4192710114203654E-4 QSAR 0.001572864665253368 Quantum Mechanics 0.59467961430623 Reflex 0.05641797168843603 Reflex Plus 6.838542022840731E-4 Semi-empirical 0.008206250427408876 Sorption 0.05388771113998495 Synthia 0.0012993229843397387 TURBOMOLE 5.470833618272584E-4 VAMP 0.0017780209259385899 Visualization 0.8996785885249264 X-Cell 0.001162552143882924 ZDOCK 0.03152567872529577

Year

2019 0.0011836320595197836 2020 0.1466858302333446 2021 0.26006087250591814 2022 0.2943016570848833 2023 0.5775278998985458 2024 1.0 2025 0.9669428474805546 2026 0.35940142035847145 2027 0.0

Keywords

target 1.0 potential 0.25051806852698216 visualization 0.21381326823175406 docking 0.21185454339001333 analysis 0.17043744854798876 between 0.14945922161978029 novel 0.09847560110142788 energy 0.07778124733868907 binding 0.06756181338178102 cell 0.054418485820535385 activity 0.05206233854713714 interaction 0.03940159536718994 promising 0.037386095892355295 synthesized 0.026258267805944303 experimental 0.02614471853975644 protein 0.01944531183467227 stability 0.019218213302296533 mechanism 0.01694722797853919 development 0.013228489510886536 effective 0.012405257331024499 synthesis 0.010616856388565589 performance 0.007437476935305306 including 0.0028103443381497146 chemical 0.002611633122320947 design 0.0
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